3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide

C16H34N4O — CID 79647875

IUPAC3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
SMILESCCCN(CCN(C)C)C1CCC(NC(C)C)(C(N)=O)C1
InChIInChI=1S/C16H34N4O/c1-6-9-20(11-10-19(4)5)14-7-8-16(12-14,15(17)21)18-13(2)3/h13-14,18H,6-12H2,1-5H3,(H2,17,21)
InChIKeyHCSFELQNNAYNFN-UHFFFAOYSA-N
MW298.47 g/mol
LogP1.03
Rot. Bonds9

About 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide

3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide (PubChem CID 79647875) has the molecular formula C16H34N4O and a molecular weight of 298.47 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
PubChem CID79647875
Molecular FormulaC16H34N4O
Molecular Weight298.47 g/mol
Exact Mass298.27
IUPAC Name3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
SMILESCCCN(CCN(C)C)C1CCC(NC(C)C)(C(N)=O)C1
InChIInChI=1S/C16H34N4O/c1-6-9-20(11-10-19(4)5)14-7-8-16(12-14,15(17)21)18-13(2)3/h13-14,18H,6-12H2,1-5H3,(H2,17,21)
InChIKeyHCSFELQNNAYNFN-UHFFFAOYSA-N
XLogP1.03
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide 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

3-[methyl(propyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79650033
1-(propan-2-ylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
CID 79646380
3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79654805
3-(dipropylamino)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79650183
3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79650663
3-[methyl(3-methylbutyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79655524
3-[ethyl(propyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid
CID 79654965
3-[ethyl(2-ethylbutyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79646901
methyl 3-[methyl(propyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxylate
CID 79649647
3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carbonitrile
CID 79640038
3-(dipropylamino)-1-(propylamino)cyclohexane-1-carboxamide
CID 79636670
3-[methyl(oxan-4-yl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79655558

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
The IUPAC name of 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide (CID 79647875) is 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide is CCCN(CCN(C)C)C1CCC(NC(C)C)(C(N)=O)C1.
What is the InChIKey of 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
The InChIKey is HCSFELQNNAYNFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N4O/c1-6-9-20(11-10-19(4)5)14-7-8-16(12-14,15(17)21)18-13(2)3/h13-14,18H,6-12H2,1-5H3,(H2,17,21).
What are the key properties of 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide has a molecular weight of 298.47 g/mol, XLogP of 1.03, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethyl-propylamino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 79647875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).