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

C13H18ClN3O2 — CID 119278060

IUPAC2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
SMILESCl.NCC(=O)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C13H17N3O2.ClH/c14-9-12(17)15-11-5-3-10(4-6-11)13(18)16-7-1-2-8-16;/h3-6H,1-2,7-9,14H2,(H,15,17);1H
InChIKeyFIDSYVSESSYRDN-UHFFFAOYSA-N
MW283.76 g/mol
LogP1.24
Rot. Bonds3

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

2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride (PubChem CID 119278060) has the molecular formula C13H18ClN3O2 and a molecular weight of 283.76 g/mol. Its IUPAC name is 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
PubChem CID119278060
Molecular FormulaC13H18ClN3O2
Molecular Weight283.76 g/mol
Exact Mass283.11
IUPAC Name2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
SMILESCl.NCC(=O)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C13H17N3O2.ClH/c14-9-12(17)15-11-5-3-10(4-6-11)13(18)16-7-1-2-8-16;/h3-6H,1-2,7-9,14H2,(H,15,17);1H
InChIKeyFIDSYVSESSYRDN-UHFFFAOYSA-N
XLogP1.24
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis[4-(piperidine-1-carbonyl)phenyl]nonanediamide
CID 43878316
3-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 61259425
2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119702402
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
N-[4-(azepane-1-carbonyl)phenyl]-2-(dimethylamino)acetamide
CID 54843928
N-[4-(azepane-1-carbonyl)phenyl]-3,3,3-trifluoropropanamide
CID 47063386
4-(methylamino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide;hydrochloride
CID 119702385
2-(4-chlorophenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 17173032
3-methylsulfonyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 134034714
4-[3-oxo-3-[4-(pyrrolidine-1-carbonyl)anilino]propyl]benzoic acid
CID 119180120
2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54810281
cyclopentyl-[2-oxo-2-[4-(piperidine-1-carbonyl)anilino]ethyl]azanium
CID 7406351

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride (CID 119278060) is 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride is Cl.NCC(=O)Nc1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
The InChIKey is FIDSYVSESSYRDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2.ClH/c14-9-12(17)15-11-5-3-10(4-6-11)13(18)16-7-1-2-8-16;/h3-6H,1-2,7-9,14H2,(H,15,17);1H.
What are the key properties of 2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride has a molecular weight of 283.76 g/mol, XLogP of 1.24, 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]acetamide;hydrochloride is sourced from PubChem (CID 119278060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).