4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide

C12H25N3O — CID 63028816

IUPAC4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide
SMILESCCNC(CCN(C)C1CCCC1)C(N)=O
InChIInChI=1S/C12H25N3O/c1-3-14-11(12(13)16)8-9-15(2)10-6-4-5-7-10/h10-11,14H,3-9H2,1-2H3,(H2,13,16)
InChIKeyRBCNDGMYFSJZQG-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.71
Rot. Bonds7

About 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide

4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide (PubChem CID 63028816) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide.

Molecular Properties

Compound Name4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide
PubChem CID63028816
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide
SMILESCCNC(CCN(C)C1CCCC1)C(N)=O
InChIInChI=1S/C12H25N3O/c1-3-14-11(12(13)16)8-9-15(2)10-6-4-5-7-10/h10-11,14H,3-9H2,1-2H3,(H2,13,16)
InChIKeyRBCNDGMYFSJZQG-UHFFFAOYSA-N
XLogP0.71
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide 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

4-[cyclopropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63027258
2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide
CID 63054490
4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanoic acid
CID 63027278
4-[(4-ethylcyclohexyl)-methylamino]-2-(propan-2-ylamino)butanamide
CID 63054146
2-(ethylamino)-4-[ethyl(methyl)amino]butanamide
CID 63029588
2-(ethylamino)-4-[methyl(pentan-3-yl)amino]butanamide
CID 63030006
4-[butyl(methyl)amino]-2-(ethylamino)butanamide
CID 63029682
4-[2,2-dimethylpropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63055540
4-cycloheptyloxy-2-(ethylamino)butanamide
CID 63040361
2-amino-4-[cycloheptyl(methyl)amino]butanoic acid
CID 63055281
ethyl 2-amino-4-[cyclohexyl(methyl)amino]butanoate
CID 63030150
4-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-(ethylamino)butanamide
CID 63055063

Frequently Asked Questions

What is the IUPAC name of 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide?
The IUPAC name of 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide (CID 63028816) is 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide.
What is the SMILES notation for 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide?
The canonical SMILES for 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide is CCNC(CCN(C)C1CCCC1)C(N)=O.
What is the InChIKey of 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide?
The InChIKey is RBCNDGMYFSJZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-3-14-11(12(13)16)8-9-15(2)10-6-4-5-7-10/h10-11,14H,3-9H2,1-2H3,(H2,13,16).
What are the key properties of 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide?
4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide has a molecular weight of 227.35 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide is sourced from PubChem (CID 63028816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).