2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide

C14H19N3O2 — CID 61259063

IUPAC2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
SMILESCC(N)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C14H19N3O2/c1-10(15)13(18)16-12-6-4-11(5-7-12)14(19)17-8-2-3-9-17/h4-7,10H,2-3,8-9,15H2,1H3,(H,16,18)
InChIKeySFKMBLKSCACBOG-UHFFFAOYSA-N
MW261.33 g/mol
LogP1.21
Rot. Bonds3

About 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide

2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide (PubChem CID 61259063) has the molecular formula C14H19N3O2 and a molecular weight of 261.33 g/mol. Its IUPAC name is 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
PubChem CID61259063
Molecular FormulaC14H19N3O2
Molecular Weight261.33 g/mol
Exact Mass261.15
IUPAC Name2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
SMILESCC(N)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C14H19N3O2/c1-10(15)13(18)16-12-6-4-11(5-7-12)14(19)17-8-2-3-9-17/h4-7,10H,2-3,8-9,15H2,1H3,(H,16,18)
InChIKeySFKMBLKSCACBOG-UHFFFAOYSA-N
XLogP1.21
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 107903159
(2S)-2-amino-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]propanamide;hydrochloride
CID 119301656
3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 61259425
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride
CID 119278079
2-amino-N-[4-(azepane-1-carbonyl)phenyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667664
2-bromo-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 62855932
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
(2R)-2-amino-N-(4-piperidin-1-ylphenyl)propanamide
CID 54996178
2-(2-methylphenoxy)-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 17196352
2-(4-methoxyphenoxy)-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 17196356
(2S)-2-amino-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide;hydrochloride
CID 119303606
(2R)-2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 124838379

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The IUPAC name of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide (CID 61259063) is 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide is CC(N)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The InChIKey is SFKMBLKSCACBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10(15)13(18)16-12-6-4-11(5-7-12)14(19)17-8-2-3-9-17/h4-7,10H,2-3,8-9,15H2,1H3,(H,16,18).
What are the key properties of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide has a molecular weight of 261.33 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 61259063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).