N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine

C32H72N4O — CID 160556177

IUPACN-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(C1CC1)C1CC1.CC(C)N(CCO)C(C)C.CCN(C(C)C)C(C)C.CCN(CC)C(C)C
InChIInChI=1S/C9H17N.C8H19NO.C8H19N.C7H17N/c1-7(2)10(8-3-4-8)9-5-6-9;1-7(2)9(5-6-10)8(3)4;1-6-9(7(2)3)8(4)5;1-5-8(6-2)7(3)4/h7-9H,3-6H2,1-2H3;7-8,10H,5-6H2,1-4H3;7-8H,6H2,1-5H3;7H,5-6H2,1-4H3
InChIKeyQYSCKUPJHUPDPS-UHFFFAOYSA-N
MW528.96 g/mol
LogP6.98
Rot. Bonds13

About N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine

N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine (PubChem CID 160556177) has the molecular formula C32H72N4O and a molecular weight of 528.96 g/mol. Its IUPAC name is N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine
PubChem CID160556177
Molecular FormulaC32H72N4O
Molecular Weight528.96 g/mol
Exact Mass528.57
IUPAC NameN-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(C1CC1)C1CC1.CC(C)N(CCO)C(C)C.CCN(C(C)C)C(C)C.CCN(CC)C(C)C
InChIInChI=1S/C9H17N.C8H19NO.C8H19N.C7H17N/c1-7(2)10(8-3-4-8)9-5-6-9;1-7(2)9(5-6-10)8(3)4;1-6-9(7(2)3)8(4)5;1-5-8(6-2)7(3)4/h7-9H,3-6H2,1-2H3;7-8,10H,5-6H2,1-4H3;7-8H,6H2,1-5H3;7H,5-6H2,1-4H3
InChIKeyQYSCKUPJHUPDPS-UHFFFAOYSA-N
XLogP6.98
TPSA33.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500528.96
LogP ≤ 56.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[di(propan-2-yl)amino]ethanol;methane
CID 145105271
ethanol;N-ethyl-N-propan-2-ylpropan-2-amine;hydrate
CID 87772214
N-ethyl-N-(1,2,3-13C3)propan-2-yl(1,2,3-13C3)propan-2-amine
CID 71309796
N-ethyl-N-propan-2-ylpropan-2-amine;propan-2-ol
CID 159144844
N-cyclopropyl-N-propan-2-ylthian-4-amine
CID 127012112
Lithium diisopropylethylamine
CID 86615685
N-ethyl-N-propan-2-ylpropan-2-amine;trihydrofluoride
CID 45108321
bis(N-ethyl-N-propan-2-ylpropan-2-amine);hydrofluoride
CID 159245549
2-[di(propan-2-yl)amino]ethanol;2-[(2-hydroxycyclohexyl)-methylamino]cyclohexan-1-ol
CID 138617266
sodium;N-ethyl-N-propan-2-ylpropan-2-amine;hydride
CID 159603940
magnesium;N-ethyl-N-propan-2-ylpropan-2-amine;dichloride
CID 174345193
sodium;N-ethyl-N-propan-2-ylpropan-2-amine;iodide
CID 174682450

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine (CID 160556177) is N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine is CC(C)N(C1CC1)C1CC1.CC(C)N(CCO)C(C)C.CCN(C(C)C)C(C)C.CCN(CC)C(C)C.
What is the InChIKey of N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine?
The InChIKey is QYSCKUPJHUPDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N.C8H19NO.C8H19N.C7H17N/c1-7(2)10(8-3-4-8)9-5-6-9;1-7(2)9(5-6-10)8(3)4;1-6-9(7(2)3)8(4)5;1-5-8(6-2)7(3)4/h7-9H,3-6H2,1-2H3;7-8,10H,5-6H2,1-4H3;7-8H,6H2,1-5H3;7H,5-6H2,1-4H3.
What are the key properties of N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine?
N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine has a molecular weight of 528.96 g/mol, XLogP of 6.98, 13 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 160556177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).