4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide

C17H25N3O2 — CID 120561704

IUPAC4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide
SMILESCc1c(NC(=O)CCC(C)N)cccc1C(=O)N1CCCC1
InChIInChI=1S/C17H25N3O2/c1-12(18)8-9-16(21)19-15-7-5-6-14(13(15)2)17(22)20-10-3-4-11-20/h5-7,12H,3-4,8-11,18H2,1-2H3,(H,19,21)
InChIKeyDZTJGQBUGIKOKH-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.30
Rot. Bonds5

About 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide

4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide (PubChem CID 120561704) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide
PubChem CID120561704
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide
SMILESCc1c(NC(=O)CCC(C)N)cccc1C(=O)N1CCCC1
InChIInChI=1S/C17H25N3O2/c1-12(18)8-9-16(21)19-15-7-5-6-14(13(15)2)17(22)20-10-3-4-11-20/h5-7,12H,3-4,8-11,18H2,1-2H3,(H,19,21)
InChIKeyDZTJGQBUGIKOKH-UHFFFAOYSA-N
XLogP2.30
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide 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-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]propanamide;hydrochloride
CID 119310023
2-(4-aminophenyl)-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 119760315
2-cyano-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 168521727
N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]-3-pyridin-2-ylpropanamide
CID 60610430
3-(2,4-dimethylphenyl)-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 60610174
3-amino-N-[2-methyl-3-(thiomorpholine-4-carbonyl)phenyl]propanamide;hydrochloride
CID 119310619
2-(1-hydroxycyclohexyl)-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 111332036
3-amino-2-methyl-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]-3-phenylpropanamide;hydrochloride
CID 119760322
2-[4-(difluoromethoxy)phenyl]-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 47089557
3-(4-bromo-2-fluorophenyl)-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 52815742
4-amino-N-[3-(piperidine-1-carbonyl)phenyl]pentanamide;hydrochloride
CID 120560909
N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 60610346

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide?
The IUPAC name of 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide (CID 120561704) is 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide.
What is the SMILES notation for 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide?
The canonical SMILES for 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide is Cc1c(NC(=O)CCC(C)N)cccc1C(=O)N1CCCC1.
What is the InChIKey of 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide?
The InChIKey is DZTJGQBUGIKOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-12(18)8-9-16(21)19-15-7-5-6-14(13(15)2)17(22)20-10-3-4-11-20/h5-7,12H,3-4,8-11,18H2,1-2H3,(H,19,21).
What are the key properties of 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide?
4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide has a molecular weight of 303.41 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]pentanamide is sourced from PubChem (CID 120561704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).