4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide

C94H190N22O9 — CID 165108305

IUPAC4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide
SMILESCC(C)CN(C)C(=O)N1CCN(C(C)C)CC1.CC(C)N1CCN(C(=O)CC2CC2)CC1.CC(C)N1CCN(C(=O)CCCO)CC1.CC(C)N1CCN(C(=O)N(C)C(C)C)CC1.CC(C)N1CCN(C(=O)N(C)C)CC1.CC(C)N1CCN(C(=O)N(C)C2CC2)CC1.CCN(C)C(=O)N1CCN(C(C)C)CC1.CCN(CC)C(=O)N1CCN(C(C)(C)C)CC1
InChIInChI=1S/2C13H27N3O.C12H23N3O.C12H25N3O.C12H22N2O.C11H23N3O.C11H22N2O2.C10H21N3O/c1-11(2)10-14(5)13(17)16-8-6-15(7-9-16)12(3)4;1-6-14(7-2)12(17)15-8-10-16(11-9-15)13(3,4)5;1-10(2)14-6-8-15(9-7-14)12(16)13(3)11-4-5-11;1-10(2)13(5)12(16)15-8-6-14(7-9-15)11(3)4;1-10(2)13-5-7-14(8-6-13)12(15)9-11-3-4-11;1-5-12(4)11(15)14-8-6-13(7-9-14)10(2)3;1-10(2)12-5-7-13(8-6-12)11(15)4-3-9-14;1-9(2)12-5-7-13(8-6-12)10(14)11(3)4/h11-12H,6-10H2,1-5H3;6-11H2,1-5H3;10-11H,4-9H2,1-3H3;10-11H,6-9H2,1-5H3;10-11H,3-9H2,1-2H3;10H,5-9H2,1-4H3;10,14H,3-9H2,1-2H3;9H,5-8H2,1-4H3
InChIKeyZNDMCOFIYPGABK-UHFFFAOYSA-N
MW1772.70 g/mol
LogP9.71
Rot. Bonds19

About 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide

4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide (PubChem CID 165108305) has the molecular formula C94H190N22O9 and a molecular weight of 1772.70 g/mol. Its IUPAC name is 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide
PubChem CID165108305
Molecular FormulaC94H190N22O9
Molecular Weight1772.70 g/mol
Exact Mass1771.51
IUPAC Name4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide
SMILESCC(C)CN(C)C(=O)N1CCN(C(C)C)CC1.CC(C)N1CCN(C(=O)CC2CC2)CC1.CC(C)N1CCN(C(=O)CCCO)CC1.CC(C)N1CCN(C(=O)N(C)C(C)C)CC1.CC(C)N1CCN(C(=O)N(C)C)CC1.CC(C)N1CCN(C(=O)N(C)C2CC2)CC1.CCN(C)C(=O)N1CCN(C(C)C)CC1.CCN(CC)C(=O)N1CCN(C(C)(C)C)CC1
InChIInChI=1S/2C13H27N3O.C12H23N3O.C12H25N3O.C12H22N2O.C11H23N3O.C11H22N2O2.C10H21N3O/c1-11(2)10-14(5)13(17)16-8-6-15(7-9-16)12(3)4;1-6-14(7-2)12(17)15-8-10-16(11-9-15)13(3,4)5;1-10(2)14-6-8-15(9-7-14)12(16)13(3)11-4-5-11;1-10(2)13(5)12(16)15-8-6-14(7-9-15)11(3)4;1-10(2)13-5-7-14(8-6-13)12(15)9-11-3-4-11;1-5-12(4)11(15)14-8-6-13(7-9-14)10(2)3;1-10(2)12-5-7-13(8-6-12)11(15)4-3-9-14;1-9(2)12-5-7-13(8-6-12)10(14)11(3)4/h11-12H,6-10H2,1-5H3;6-11H2,1-5H3;10-11H,4-9H2,1-3H3;10-11H,6-9H2,1-5H3;10-11H,3-9H2,1-2H3;10H,5-9H2,1-4H3;10,14H,3-9H2,1-2H3;9H,5-8H2,1-4H3
InChIKeyZNDMCOFIYPGABK-UHFFFAOYSA-N
XLogP9.71
TPSA228.07 Ų
H-Bond Donors1
H-Bond Acceptors17
Rotatable Bonds19
Heavy Atoms125
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001772.70
LogP ≤ 59.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1017

Analyze 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;3,3-dimethyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide;3-methyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one
CID 158305711
4-tert-butyl-N-cyclopropyl-N-methylpiperazine-1-carboxamide;4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;4-tert-butyl-N,N-dimethylpiperazine-1-carboxamide;4-tert-butyl-N-ethyl-N-methylpiperazine-1-carboxamide;4-tert-butyl-N-methyl-N-propan-2-ylpiperazine-1-carboxamide;1-(4-tert-butylpiperazin-1-yl)-2-cyclopropylethanone;1-(4-tert-butylpiperazin-1-yl)-3,3-dimethylbutan-1-one;1-(4-tert-butylpiperazin-1-yl)-3-methylbutan-1-one;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide;4-methyl-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one
CID 159169331
4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;4-tert-butyl-N,N-dimethylpiperazine-1-carboxamide;4-tert-butyl-N-ethyl-N-methylpiperazine-1-carboxamide;1-(4-tert-butylpiperazin-1-yl)-3,3-dimethylbutan-1-one;1-(4-tert-butylpiperazin-1-yl)-3-methylbutan-1-one;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide;4-methyl-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one
CID 160034308
N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N-(2-hydroxyethyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;3-(hydroxymethyl)-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide
CID 160484494
1-(4-tert-butylpiperazin-1-yl)-3-(hydroxymethyl)pentan-1-one;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N-(2-hydroxyethyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-(2-methoxyethyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-methoxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;2-(oxan-4-yl)-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 161980709
Cyclopropyl-[2-(hydroxymethyl)-4-methylpiperazin-1-yl]methanone;cyclopropyl-[3-(hydroxymethyl)-4-methylpiperazin-1-yl]methanone;(1,4-dimethylpiperidin-4-yl)methanol;(4-ethyl-1-methylpiperidin-4-yl)methanol;(1-methylcyclopropyl)-(4-methylpiperazin-1-yl)methanone;(2-methylcyclopropyl)-(4-methylpiperazin-1-yl)methanone
CID 162142647

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide?
The IUPAC name of 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide (CID 165108305) is 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide?
The canonical SMILES for 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide is CC(C)CN(C)C(=O)N1CCN(C(C)C)CC1.CC(C)N1CCN(C(=O)CC2CC2)CC1.CC(C)N1CCN(C(=O)CCCO)CC1.CC(C)N1CCN(C(=O)N(C)C(C)C)CC1.CC(C)N1CCN(C(=O)N(C)C)CC1.CC(C)N1CCN(C(=O)N(C)C2CC2)CC1.CCN(C)C(=O)N1CCN(C(C)C)CC1.CCN(CC)C(=O)N1CCN(C(C)(C)C)CC1.
What is the InChIKey of 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide?
The InChIKey is ZNDMCOFIYPGABK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H27N3O.C12H23N3O.C12H25N3O.C12H22N2O.C11H23N3O.C11H22N2O2.C10H21N3O/c1-11(2)10-14(5)13(17)16-8-6-15(7-9-16)12(3)4;1-6-14(7-2)12(17)15-8-10-16(11-9-15)13(3,4)5;1-10(2)14-6-8-15(9-7-14)12(16)13(3)11-4-5-11;1-10(2)13(5)12(16)15-8-6-14(7-9-15)11(3)4;1-10(2)13-5-7-14(8-6-13)12(15)9-11-3-4-11;1-5-12(4)11(15)14-8-6-13(7-9-14)10(2)3;1-10(2)12-5-7-13(8-6-12)11(15)4-3-9-14;1-9(2)12-5-7-13(8-6-12)10(14)11(3)4/h11-12H,6-10H2,1-5H3;6-11H2,1-5H3;10-11H,4-9H2,1-3H3;10-11H,6-9H2,1-5H3;10-11H,3-9H2,1-2H3;10H,5-9H2,1-4H3;10,14H,3-9H2,1-2H3;9H,5-8H2,1-4H3.
What are the key properties of 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide?
4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide has a molecular weight of 1772.70 g/mol, XLogP of 9.71, 19 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;N-cyclopropyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;2-cyclopropyl-1-(4-propan-2-ylpiperazin-1-yl)ethanone;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;4-hydroxy-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-methyl-N,4-di(propan-2-yl)piperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 165108305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).