1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine

C117H247N21 — CID 158522925

IUPAC1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine
SMILESCC(C)(C)N1CCC(C2(N)CC2)C1.CC(C)(C)N1CCC(CN)C1.CC(C)(N)C1CCN(C(C)(C)C)C1.CC(N)C1CCN(C(C)(C)C)C1.CC1CN(C(C)(C)C)CC1C#N.CC1CN(C(C)(C)C)CC1CNC1CC1.CCC1CCN(C(C)(C)C)C1.CN(C)C1CCN(C(C)(C)C)C1.CNC(C)(C)C1CCN(C(C)(C)C)C1.CNC(C)C1CCN(C(C)(C)C)C1.CNCC1CCN(C(C)(C)C)C1
InChIInChI=1S/C13H26N2.C12H26N2.C11H22N2.2C11H24N2.C10H18N2.3C10H22N2.C10H21N.C9H20N2/c1-10-8-15(13(2,3)4)9-11(10)7-14-12-5-6-12;1-11(2,3)14-8-7-10(9-14)12(4,5)13-6;1-10(2,3)13-7-4-9(8-13)11(12)5-6-11;1-10(2,3)13-7-6-9(8-13)11(4,5)12;1-9(12-5)10-6-7-13(8-10)11(2,3)4;1-8-6-12(10(2,3)4)7-9(8)5-11;1-10(2,3)12-7-6-9(8-12)11(4)5;1-10(2,3)12-6-5-9(8-12)7-11-4;1-8(11)9-5-6-12(7-9)10(2,3)4;1-5-9-6-7-11(8-9)10(2,3)4;1-9(2,3)11-5-4-8(6-10)7-11/h10-12,14H,5-9H2,1-4H3;10,13H,7-9H2,1-6H3;9H,4-8,12H2,1-3H3;9H,6-8,12H2,1-5H3;9-10,12H,6-8H2,1-5H3;8-9H,6-7H2,1-4H3;9H,6-8H2,1-5H3;9,11H,5-8H2,1-4H3;8-9H,5-7,11H2,1-4H3;9H,5-8H2,1-4H3;8H,4-7,10H2,1-3H3
InChIKeyHMLACCFUOMVUOL-UHFFFAOYSA-N
MW1948.41 g/mol
LogP19.03
Rot. Bonds15

About 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine

1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine (PubChem CID 158522925) has the molecular formula C117H247N21 and a molecular weight of 1948.41 g/mol. Its IUPAC name is 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine.

Molecular Properties

Compound Name1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine
PubChem CID158522925
Molecular FormulaC117H247N21
Molecular Weight1948.41 g/mol
Exact Mass1947.00
IUPAC Name1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine
SMILESCC(C)(C)N1CCC(C2(N)CC2)C1.CC(C)(C)N1CCC(CN)C1.CC(C)(N)C1CCN(C(C)(C)C)C1.CC(N)C1CCN(C(C)(C)C)C1.CC1CN(C(C)(C)C)CC1C#N.CC1CN(C(C)(C)C)CC1CNC1CC1.CCC1CCN(C(C)(C)C)C1.CN(C)C1CCN(C(C)(C)C)C1.CNC(C)(C)C1CCN(C(C)(C)C)C1.CNC(C)C1CCN(C(C)(C)C)C1.CNCC1CCN(C(C)(C)C)C1
InChIInChI=1S/C13H26N2.C12H26N2.C11H22N2.2C11H24N2.C10H18N2.3C10H22N2.C10H21N.C9H20N2/c1-10-8-15(13(2,3)4)9-11(10)7-14-12-5-6-12;1-11(2,3)14-8-7-10(9-14)12(4,5)13-6;1-10(2,3)13-7-4-9(8-13)11(12)5-6-11;1-10(2,3)13-7-6-9(8-13)11(4,5)12;1-9(12-5)10-6-7-13(8-10)11(2,3)4;1-8-6-12(10(2,3)4)7-9(8)5-11;1-10(2,3)12-7-6-9(8-12)11(4)5;1-10(2,3)12-6-5-9(8-12)7-11-4;1-8(11)9-5-6-12(7-9)10(2,3)4;1-5-9-6-7-11(8-9)10(2,3)4;1-9(2,3)11-5-4-8(6-10)7-11/h10-12,14H,5-9H2,1-4H3;10,13H,7-9H2,1-6H3;9H,4-8,12H2,1-3H3;9H,6-8,12H2,1-5H3;9-10,12H,6-8H2,1-5H3;8-9H,6-7H2,1-4H3;9H,6-8H2,1-5H3;9,11H,5-8H2,1-4H3;8-9H,5-7,11H2,1-4H3;9H,5-8H2,1-4H3;8H,4-7,10H2,1-3H3
InChIKeyHMLACCFUOMVUOL-UHFFFAOYSA-N
XLogP19.03
TPSA214.87 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms138
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001948.41
LogP ≤ 519.03
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine?
The IUPAC name of 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine (CID 158522925) is 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine.
What is the SMILES notation for 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine?
The canonical SMILES for 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine is CC(C)(C)N1CCC(C2(N)CC2)C1.CC(C)(C)N1CCC(CN)C1.CC(C)(N)C1CCN(C(C)(C)C)C1.CC(N)C1CCN(C(C)(C)C)C1.CC1CN(C(C)(C)C)CC1C#N.CC1CN(C(C)(C)C)CC1CNC1CC1.CCC1CCN(C(C)(C)C)C1.CN(C)C1CCN(C(C)(C)C)C1.CNC(C)(C)C1CCN(C(C)(C)C)C1.CNC(C)C1CCN(C(C)(C)C)C1.CNCC1CCN(C(C)(C)C)C1.
What is the InChIKey of 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine?
The InChIKey is HMLACCFUOMVUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2.C12H26N2.C11H22N2.2C11H24N2.C10H18N2.3C10H22N2.C10H21N.C9H20N2/c1-10-8-15(13(2,3)4)9-11(10)7-14-12-5-6-12;1-11(2,3)14-8-7-10(9-14)12(4,5)13-6;1-10(2,3)13-7-4-9(8-13)11(12)5-6-11;1-10(2,3)13-7-6-9(8-13)11(4,5)12;1-9(12-5)10-6-7-13(8-10)11(2,3)4;1-8-6-12(10(2,3)4)7-9(8)5-11;1-10(2,3)12-7-6-9(8-12)11(4)5;1-10(2,3)12-6-5-9(8-12)7-11-4;1-8(11)9-5-6-12(7-9)10(2,3)4;1-5-9-6-7-11(8-9)10(2,3)4;1-9(2,3)11-5-4-8(6-10)7-11/h10-12,14H,5-9H2,1-4H3;10,13H,7-9H2,1-6H3;9H,4-8,12H2,1-3H3;9H,6-8,12H2,1-5H3;9-10,12H,6-8H2,1-5H3;8-9H,6-7H2,1-4H3;9H,6-8H2,1-5H3;9,11H,5-8H2,1-4H3;8-9H,5-7,11H2,1-4H3;9H,5-8H2,1-4H3;8H,4-7,10H2,1-3H3.
What are the key properties of 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine?
1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine has a molecular weight of 1948.41 g/mol, XLogP of 19.03, 15 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-3-ethylpyrrolidine;1-tert-butyl-4-methylpyrrolidine-3-carbonitrile;N-[(1-tert-butyl-4-methylpyrrolidin-3-yl)methyl]cyclopropanamine;1-(1-tert-butylpyrrolidin-3-yl)cyclopropan-1-amine;1-(1-tert-butylpyrrolidin-3-yl)ethanamine;(1-tert-butylpyrrolidin-3-yl)methanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylethanamine;1-(1-tert-butylpyrrolidin-3-yl)-N-methylmethanamine;2-(1-tert-butylpyrrolidin-3-yl)-N-methylpropan-2-amine;2-(1-tert-butylpyrrolidin-3-yl)propan-2-amine is sourced from PubChem (CID 158522925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).