2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide

C18H12Cl2N2O — CID 45485789

IUPAC2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide
SMILESC1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)C3=CC=CC=N3)Cl
InChIInChI=1S/C18H12Cl2N2O/c19-15-6-2-1-5-13(15)18(23)22-12-8-9-16(20)14(11-12)17-7-3-4-10-21-17/h1-11H,(H,22,23)
InChIKeyPXXKWQWERILNNI-UHFFFAOYSA-N
MW343.20 g/mol
LogP4.60
Rot. Bonds3

About 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide

2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide (PubChem CID 45485789) has the molecular formula C18H12Cl2N2O and a molecular weight of 343.20 g/mol. Its IUPAC name is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide
PubChem CID45485789
Molecular FormulaC18H12Cl2N2O
Molecular Weight343.20 g/mol
Exact Mass342.03
IUPAC Name2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide
SMILESC1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)C3=CC=CC=N3)Cl
InChIInChI=1S/C18H12Cl2N2O/c19-15-6-2-1-5-13(15)18(23)22-12-8-9-16(20)14(11-12)17-7-3-4-10-21-17/h1-11H,(H,22,23)
InChIKeyPXXKWQWERILNNI-UHFFFAOYSA-N
XLogP4.60
TPSA42.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity406

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.20
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Boscalid
CID 213013
Vismodegib
CID 24776445
2-Chloro-5-nitro-N-4-pyridinylbenzamide
CID 2777391
Ica-27243
CID 9903497
Benzamide, 2-chloro-N-4-pyridinyl-
CID 5121684
N-(4-Chlorophenyl)-2-[(pyridin-4-ylmethyl)amino]benzamide
CID 9797919
2-chloro-N-(pyridin-3-yl)benzamide
CID 587129
2,6-dichloro-N-(pyridin-4-yl)benzamide
CID 3120536
2,4-dichloro-N-(pyridin-3-yl)benzamide
CID 599595
N-[2-(4-chlorophenyl)phenyl]pyridine-3-carboxamide
CID 67120985
Ztz240
CID 3780776
N-(2-aminophenyl)-4-(3-chloro-5-{[4-(propan-2-yl)piperazin-1-yl]methyl}pyridin-2-yl)benzamide
CID 11597868

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide?
The IUPAC name of 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide (CID 45485789) is 2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)benzamide.
What is the SMILES notation for 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide?
The canonical SMILES for 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide is C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)C3=CC=CC=N3)Cl.
What is the InChIKey of 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide?
The InChIKey is PXXKWQWERILNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2N2O/c19-15-6-2-1-5-13(15)18(23)22-12-8-9-16(20)14(11-12)17-7-3-4-10-21-17/h1-11H,(H,22,23).
What are the key properties of 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide?
2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide has a molecular weight of 343.20 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)benzamide is sourced from PubChem (CID 45485789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).