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

C19H22ClN3O2 — CID 119702402

IUPAC2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
SMILESCl.O=C(CNc1ccccc1)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C19H21N3O2.ClH/c23-18(14-20-16-6-2-1-3-7-16)21-17-10-8-15(9-11-17)19(24)22-12-4-5-13-22;/h1-3,6-11,20H,4-5,12-14H2,(H,21,23);1H
InChIKeyKHQJHQFPLUJLIP-UHFFFAOYSA-N
MW359.86 g/mol
LogP3.39
Rot. Bonds5

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

2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride (PubChem CID 119702402) has the molecular formula C19H22ClN3O2 and a molecular weight of 359.86 g/mol. Its IUPAC name is 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
PubChem CID119702402
Molecular FormulaC19H22ClN3O2
Molecular Weight359.86 g/mol
Exact Mass359.14
IUPAC Name2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
SMILESCl.O=C(CNc1ccccc1)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C19H21N3O2.ClH/c23-18(14-20-16-6-2-1-3-7-16)21-17-10-8-15(9-11-17)19(24)22-12-4-5-13-22;/h1-3,6-11,20H,4-5,12-14H2,(H,21,23);1H
InChIKeyKHQJHQFPLUJLIP-UHFFFAOYSA-N
XLogP3.39
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.86
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
CID 54832695
N-[4-(2-phenoxyethoxy)phenyl]-2-[4-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54834026
N-[4-[[2-oxo-2-[4-(piperidine-1-carbonyl)anilino]ethyl]amino]phenyl]-3-phenylpropanamide
CID 54839493
2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54810281
2-[4-(azepane-1-carbonyl)anilino]-N-(4-bromophenyl)acetamide
CID 54834872
N-(4-fluorophenyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841618
4-[[2-[4-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]-N-methyl-N-phenylbenzamide
CID 54838199
N-(4-phenylmethoxyphenyl)-2-[4-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54833960
N-[4-[[2-[4-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]butanamide
CID 54836878
N-(2-bromophenyl)-2-[4-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54834057
N-[3-[[2-[4-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]-3-phenylpropanamide
CID 54837346
N-[3-[[2-[4-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]phenyl]butanamide
CID 54834226

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
The IUPAC name of 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride (CID 119702402) is 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride is Cl.O=C(CNc1ccccc1)Nc1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
The InChIKey is KHQJHQFPLUJLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2.ClH/c23-18(14-20-16-6-2-1-3-7-16)21-17-10-8-15(9-11-17)19(24)22-12-4-5-13-22;/h1-3,6-11,20H,4-5,12-14H2,(H,21,23);1H.
What are the key properties of 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride?
2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride has a molecular weight of 359.86 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 119702402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).