2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide

C12H21N3O — CID 63315824

IUPAC2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide
SMILESCC(C#N)C(=O)NCCN(C)C1CCCC1
InChIInChI=1S/C12H21N3O/c1-10(9-13)12(16)14-7-8-15(2)11-5-3-4-6-11/h10-11H,3-8H2,1-2H3,(H,14,16)
InChIKeyRPZWJIPPUWNTRG-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.14
Rot. Bonds5

About 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide

2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide (PubChem CID 63315824) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide.

Molecular Properties

Compound Name2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide
PubChem CID63315824
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide
SMILESCC(C#N)C(=O)NCCN(C)C1CCCC1
InChIInChI=1S/C12H21N3O/c1-10(9-13)12(16)14-7-8-15(2)11-5-3-4-6-11/h10-11H,3-8H2,1-2H3,(H,14,16)
InChIKeyRPZWJIPPUWNTRG-UHFFFAOYSA-N
XLogP1.14
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide 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

N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide
CID 59205256
2-[2-[cyclopentyl(methyl)amino]ethylamino]propanenitrile
CID 63318071
2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide
CID 63316290
5-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methylpentanamide
CID 113441005
1-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]-3-methylcyclobutane-1-carboxamide
CID 80502256
3-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methyl-3-phenylpropanamide
CID 119878746
N'-(cyanomethyl)-N-[2-[cyclopropyl(methyl)amino]ethyl]oxamide
CID 62978700
3-[2-[cyclopentyl(methyl)amino]ethyl]-1-ethyl-1-methylurea
CID 115613946
2-bromo-N-[3-[cyclohexyl(methyl)amino]propyl]propanamide
CID 107904686
2-amino-N-[3-[cyclohexyl(methyl)amino]propyl]propanamide
CID 54880376
(2S)-2-[2-[cyclopentyl(methyl)amino]ethylcarbamoylamino]-3-methylbutanoic acid
CID 63316795
2-[2-[cyclopentyl(methyl)amino]ethylamino]-N,N-dimethylpropanamide
CID 63318305

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide?
The IUPAC name of 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide (CID 63315824) is 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide.
What is the SMILES notation for 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide?
The canonical SMILES for 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide is CC(C#N)C(=O)NCCN(C)C1CCCC1.
What is the InChIKey of 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide?
The InChIKey is RPZWJIPPUWNTRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-10(9-13)12(16)14-7-8-15(2)11-5-3-4-6-11/h10-11H,3-8H2,1-2H3,(H,14,16).
What are the key properties of 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide?
2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide has a molecular weight of 223.32 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[2-[cyclopentyl(methyl)amino]ethyl]propanamide is sourced from PubChem (CID 63315824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).