2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine

C92H199N15 — CID 157250433

IUPAC2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)CC1(C)CCN(C(C)C)C1.CC(C)CC1CN(C(C)C)CC1N.CC(C)CC1CN(C(C)C)CC1N(C)C.CC(C)N1CCN(C(C)C)C(C)(C)C1.CC(C)N1CCN(C(C)C)CC1.CC(C)NC1CCCN(C(C)C)C1.CC(C)NC1CCCN(C(C)C)C1.CNC1CN(C(C)C)CC1CC(C)C
InChIInChI=1S/C13H28N2.2C12H26N2.C12H25N.3C11H24N2.C10H22N2/c1-10(2)7-12-8-15(11(3)4)9-13(12)14(5)6;1-9(2)6-11-7-14(10(3)4)8-12(11)13-5;1-10(2)13-7-8-14(11(3)4)12(5,6)9-13;1-10(2)8-12(5)6-7-13(9-12)11(3)4;1-8(2)5-10-6-13(9(3)4)7-11(10)12;2*1-9(2)12-11-6-5-7-13(8-11)10(3)4;1-9(2)11-5-7-12(8-6-11)10(3)4/h10-13H,7-9H2,1-6H3;9-13H,6-8H2,1-5H3;10-11H,7-9H2,1-6H3;10-11H,6-9H2,1-5H3;8-11H,5-7,12H2,1-4H3;2*9-12H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3
InChIKeyAWGVEQDPEPANGA-UHFFFAOYSA-N
MW1515.71 g/mol
LogP16.45
Rot. Bonds24

About 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine

2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 157250433) has the molecular formula C92H199N15 and a molecular weight of 1515.71 g/mol. Its IUPAC name is 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine
PubChem CID157250433
Molecular FormulaC92H199N15
Molecular Weight1515.71 g/mol
Exact Mass1514.60
IUPAC Name2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)CC1(C)CCN(C(C)C)C1.CC(C)CC1CN(C(C)C)CC1N.CC(C)CC1CN(C(C)C)CC1N(C)C.CC(C)N1CCN(C(C)C)C(C)(C)C1.CC(C)N1CCN(C(C)C)CC1.CC(C)NC1CCCN(C(C)C)C1.CC(C)NC1CCCN(C(C)C)C1.CNC1CN(C(C)C)CC1CC(C)C
InChIInChI=1S/C13H28N2.2C12H26N2.C12H25N.3C11H24N2.C10H22N2/c1-10(2)7-12-8-15(11(3)4)9-13(12)14(5)6;1-9(2)6-11-7-14(10(3)4)8-12(11)13-5;1-10(2)13-7-8-14(11(3)4)12(5,6)9-13;1-10(2)8-12(5)6-7-13(9-12)11(3)4;1-8(2)5-10-6-13(9(3)4)7-11(10)12;2*1-9(2)12-11-6-5-7-13(8-11)10(3)4;1-9(2)11-5-7-12(8-6-11)10(3)4/h10-13H,7-9H2,1-6H3;9-13H,6-8H2,1-5H3;10-11H,7-9H2,1-6H3;10-11H,6-9H2,1-5H3;8-11H,5-7,12H2,1-4H3;2*9-12H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3
InChIKeyAWGVEQDPEPANGA-UHFFFAOYSA-N
XLogP16.45
TPSA97.75 Ų
H-Bond Donors4
H-Bond Acceptors15
Rotatable Bonds24
Heavy Atoms107
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001515.71
LogP ≤ 516.45
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1015

Analyze 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine with MolForge

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Related Compounds

5-[[(2R,6S)-4-tert-butyl-6-[[2-[2,3-dimethyl-3-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-yl]-5-ethyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-4-yl]methyl]piperazin-2-yl]methyl]-2-[3-(2,7-diazaspiro[3.5]nonan-2-yl)-2,3-dimethylbutan-2-yl]-7-methyl-2,7-diazaspiro[3.5]nonane
CID 146201388
Bis(1,4-ditert-butylpiperidine);bis(2,5-ditert-butylpiperidine);tris(1,3-ditert-butylpyrrolidine)
CID 157401925
2-tert-butyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;2-tert-butyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine;3-tert-butyl-3,8-diazabicyclo[3.2.1]octane;7-tert-butyl-1,7-diazaspiro[4.4]nonane;ethane
CID 157444226
2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;8-tert-butyl-2,8-diazaspiro[4.5]decane;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butylpiperidin-4-amine;(1-tert-butylpiperidin-4-yl)methanamine;1-(1-tert-butylpiperidin-4-yl)-N-methylmethanamine;N,2-dimethyl-N-(piperidin-4-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-4-ylmethyl)propan-2-amine
CID 157518255
8-tert-butyl-8-azaspiro[4.5]decane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-2,8-diazaspiro[4.5]decane;1-tert-butyl-4-ethylpiperidine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butylpiperidin-4-amine;1-tert-butyl-4-propylpiperidine;N,2-dimethyl-N-(piperidin-1-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-1-ylmethyl)propan-2-amine
CID 157559876
N-ethyl-2,2,3,4,5,7,7-heptamethyl-1-azabicyclo[2.2.1]heptan-3-amine;N-ethyl-1,2,2,3,4,5,7,7-octamethyl-1-azoniabicyclo[2.2.1]heptan-3-amine
CID 157711387
8-Tert-butyl-2,8-diazaspiro[4.5]decane;3-tert-butyl-3,9-diazaspiro[5.5]undecane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[4.4]nonane;octakis(2-methylpropane);2-propan-2-yl-2,8-diazaspiro[5.5]undecane;2-propan-2-yl-2,9-diazaspiro[5.5]undecane
CID 157824315
1-Tert-butyl-4-piperidin-4-ylpiperidine;1-tert-butyl-4-pyrrolidin-2-ylpiperidine;1-tert-butyl-3-pyrrolidin-1-ylpyrrolidine
CID 158421165
N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine
CID 159161176
Bis(1,4-ditert-butylpiperidine);bis(2,5-ditert-butylpiperidine);bis(1,3-ditert-butylpyrrolidine);2,4-ditert-butylpyrrolidine
CID 159525172
2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine
CID 159600647
N,3-dimethyl-N-propan-2-ylbutan-1-amine;1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;(3R)-1,3-di(propan-2-yl)piperidine;(3S)-1,3-di(propan-2-yl)piperidine;1,3-di(propan-2-yl)pyrrolidine;(3S)-1,3-di(propan-2-yl)pyrrolidine;(3R)-1,3-di(propan-2-yl)pyrrolidine;3-methyl-N-propan-2-ylbutan-1-amine
CID 159987408

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine (CID 157250433) is 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine is CC(C)CC1(C)CCN(C(C)C)C1.CC(C)CC1CN(C(C)C)CC1N.CC(C)CC1CN(C(C)C)CC1N(C)C.CC(C)N1CCN(C(C)C)C(C)(C)C1.CC(C)N1CCN(C(C)C)CC1.CC(C)NC1CCCN(C(C)C)C1.CC(C)NC1CCCN(C(C)C)C1.CNC1CN(C(C)C)CC1CC(C)C.
What is the InChIKey of 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is AWGVEQDPEPANGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2.2C12H26N2.C12H25N.3C11H24N2.C10H22N2/c1-10(2)7-12-8-15(11(3)4)9-13(12)14(5)6;1-9(2)6-11-7-14(10(3)4)8-12(11)13-5;1-10(2)13-7-8-14(11(3)4)12(5,6)9-13;1-10(2)8-12(5)6-7-13(9-12)11(3)4;1-8(2)5-10-6-13(9(3)4)7-11(10)12;2*1-9(2)12-11-6-5-7-13(8-11)10(3)4;1-9(2)11-5-7-12(8-6-11)10(3)4/h10-13H,7-9H2,1-6H3;9-13H,6-8H2,1-5H3;10-11H,7-9H2,1-6H3;10-11H,6-9H2,1-5H3;8-11H,5-7,12H2,1-4H3;2*9-12H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3.
What are the key properties of 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine?
2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 1515.71 g/mol, XLogP of 16.45, 24 rotatable bonds, 4 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1,4-di(propan-2-yl)piperazine;N,N-dimethyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;bis(N,1-di(propan-2-yl)piperidin-3-amine);N-methyl-4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine;3-methyl-3-(2-methylpropyl)-1-propan-2-ylpyrrolidine;4-(2-methylpropyl)-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 157250433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).