2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride

C19H17Cl2N3O — CID 90111641

IUPAC2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride
SMILESCl.NC(=O)Cc1ccc(Nc2ccnc(-c3cccc(Cl)c3)c2)cc1
InChIInChI=1S/C19H16ClN3O.ClH/c20-15-3-1-2-14(11-15)18-12-17(8-9-22-18)23-16-6-4-13(5-7-16)10-19(21)24;/h1-9,11-12H,10H2,(H2,21,24)(H,22,23);1H
InChIKeyVBMRXVGVKGZTIR-UHFFFAOYSA-N
MW374.27 g/mol
LogP4.60
Rot. Bonds5

About 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride

2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride (PubChem CID 90111641) has the molecular formula C19H17Cl2N3O and a molecular weight of 374.27 g/mol. Its IUPAC name is 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride
PubChem CID90111641
Molecular FormulaC19H17Cl2N3O
Molecular Weight374.27 g/mol
Exact Mass373.07
IUPAC Name2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride
SMILESCl.NC(=O)Cc1ccc(Nc2ccnc(-c3cccc(Cl)c3)c2)cc1
InChIInChI=1S/C19H16ClN3O.ClH/c20-15-3-1-2-14(11-15)18-12-17(8-9-22-18)23-16-6-4-13(5-7-16)10-19(21)24;/h1-9,11-12H,10H2,(H2,21,24)(H,22,23);1H
InChIKeyVBMRXVGVKGZTIR-UHFFFAOYSA-N
XLogP4.60
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.27
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-amino-2-oxoethyl)phenyl]-3-(pyrimidin-2-ylamino)benzamide
CID 31861938
2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide
CID 60790039
2-(4-pyridin-2-ylphenyl)acetamide
CID 57447645
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]-methylamino]phenyl]acetamide
CID 118037253
N-[4-(3-chloroanilino)phenyl]-2-(4-methoxyphenyl)acetamide
CID 112986980
N-[6-(3-chloroanilino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113018544
bis(1-[6-(3-chlorophenyl)pyrimidin-4-yl]-2-pyridin-3-ylethanone);hydrochloride
CID 160624132
3-[6-(3,4-dichloroanilino)pyrimidin-4-yl]benzamide
CID 46703969
2-(4-aminophenyl)-N-[4-[(2-dibenzofuran-4-yl-4-pyridinyl)amino]phenyl]acetamide
CID 156902521
2-[4-[(8-chloroimidazo[1,5-a]quinoxalin-4-yl)amino]phenyl]acetamide
CID 166372713
1-[4-[2-(3-chloroanilino)pyrimidin-4-yl]-2-pyridinyl]ethanone
CID 67365361
N-[4-(2-amino-2-oxoethyl)phenyl]-1-(3-chlorophenyl)-5-propan-2-ylpyrazole-4-carboxamide
CID 31862135

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride?
The IUPAC name of 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride (CID 90111641) is 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride is Cl.NC(=O)Cc1ccc(Nc2ccnc(-c3cccc(Cl)c3)c2)cc1.
What is the InChIKey of 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride?
The InChIKey is VBMRXVGVKGZTIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O.ClH/c20-15-3-1-2-14(11-15)18-12-17(8-9-22-18)23-16-6-4-13(5-7-16)10-19(21)24;/h1-9,11-12H,10H2,(H2,21,24)(H,22,23);1H.
What are the key properties of 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride?
2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride has a molecular weight of 374.27 g/mol, XLogP of 4.60, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[2-(3-chlorophenyl)-4-pyridinyl]amino]phenyl]acetamide;hydrochloride is sourced from PubChem (CID 90111641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).