2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride

C16H24ClN3O2 — CID 119278079

IUPAC2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1.Cl
InChIInChI=1S/C16H23N3O2.ClH/c1-2-5-14(17)15(20)18-13-8-6-12(7-9-13)16(21)19-10-3-4-11-19;/h6-9,14H,2-5,10-11,17H2,1H3,(H,18,20);1H
InChIKeyBCHNGKFJPVWGMH-UHFFFAOYSA-N
MW325.84 g/mol
LogP2.41
Rot. Bonds5

About 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride

2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride (PubChem CID 119278079) has the molecular formula C16H24ClN3O2 and a molecular weight of 325.84 g/mol. Its IUPAC name is 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride
PubChem CID119278079
Molecular FormulaC16H24ClN3O2
Molecular Weight325.84 g/mol
Exact Mass325.16
IUPAC Name2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1.Cl
InChIInChI=1S/C16H23N3O2.ClH/c1-2-5-14(17)15(20)18-13-8-6-12(7-9-13)16(21)19-10-3-4-11-19;/h6-9,14H,2-5,10-11,17H2,1H3,(H,18,20);1H
InChIKeyBCHNGKFJPVWGMH-UHFFFAOYSA-N
XLogP2.41
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 61259063
2-amino-N-(4-pyrrolidin-1-ylphenyl)pentanamide
CID 43713003
4-(2-aminopentanoylamino)benzamide;hydrochloride
CID 119262578
2-cyano-N-[4-(piperidine-1-carbonyl)phenyl]pentanamide
CID 153387376
2-bromo-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 62855932
(2R)-N-(4-acetamidophenyl)-2-aminopentanamide
CID 113263757
2-bromo-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 107903159
2-amino-N-[4-(azepane-1-carbonyl)phenyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667664
3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 61259425
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119278060
(2R)-2-amino-N-(4-bromophenyl)pentanamide
CID 103793741
(2S)-2-amino-N-[4-(propanoylamino)phenyl]pentanamide
CID 107568598

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride (CID 119278079) is 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride is CCCC(N)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1.Cl.
What is the InChIKey of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride?
The InChIKey is BCHNGKFJPVWGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2.ClH/c1-2-5-14(17)15(20)18-13-8-6-12(7-9-13)16(21)19-10-3-4-11-19;/h6-9,14H,2-5,10-11,17H2,1H3,(H,18,20);1H.
What are the key properties of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride?
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]pentanamide;hydrochloride has a molecular weight of 325.84 g/mol, XLogP of 2.41, 5 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]pentanamide;hydrochloride is sourced from PubChem (CID 119278079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).