3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide

C15H21N3O2 — CID 61259425

IUPAC3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
SMILESCC(N)CC(=O)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C15H21N3O2/c1-11(16)10-14(19)17-13-6-4-12(5-7-13)15(20)18-8-2-3-9-18/h4-7,11H,2-3,8-10,16H2,1H3,(H,17,19)
InChIKeyQMUQUFFMTGFSPH-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.60
Rot. Bonds4

About 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide

3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide (PubChem CID 61259425) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide.

Molecular Properties

Compound Name3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
PubChem CID61259425
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
SMILESCC(N)CC(=O)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C15H21N3O2/c1-11(16)10-14(19)17-13-6-4-12(5-7-13)15(20)18-8-2-3-9-18/h4-7,11H,2-3,8-10,16H2,1H3,(H,17,19)
InChIKeyQMUQUFFMTGFSPH-UHFFFAOYSA-N
XLogP1.60
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]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

2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 61259063
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119278060
N-[4-(azepane-1-carbonyl)phenyl]-2-(dimethylamino)acetamide
CID 54843928
2-bromo-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 107903159
N,N'-bis[4-(piperidine-1-carbonyl)phenyl]nonanediamide
CID 43878316
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride
CID 119278079
N-(4-propan-2-yloxyphenyl)-2-[4-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54834060
3-methylsulfonyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 134034714
2-(4-methylphenyl)-N-[4-(piperidine-1-carbonyl)phenyl]acetamide
CID 6468250
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
N-[4-(azepane-1-carbonyl)phenyl]-3,3,3-trifluoropropanamide
CID 47063386
4-(methylamino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide;hydrochloride
CID 119702385

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide?
The IUPAC name of 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide (CID 61259425) is 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide.
What is the SMILES notation for 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide?
The canonical SMILES for 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide is CC(N)CC(=O)Nc1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide?
The InChIKey is QMUQUFFMTGFSPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11(16)10-14(19)17-13-6-4-12(5-7-13)15(20)18-8-2-3-9-18/h4-7,11H,2-3,8-10,16H2,1H3,(H,17,19).
What are the key properties of 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide?
3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide has a molecular weight of 275.35 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide is sourced from PubChem (CID 61259425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).