3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide

C20H17ClN2O2 — CID 30155863

IUPAC3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide
SMILESO=C(NCc1ccncc1)c1cccc(OCc2ccccc2Cl)c1
InChIInChI=1S/C20H17ClN2O2/c21-19-7-2-1-4-17(19)14-25-18-6-3-5-16(12-18)20(24)23-13-15-8-10-22-11-9-15/h1-12H,13-14H2,(H,23,24)
InChIKeyHVXJGVKXQBQXQH-UHFFFAOYSA-N
MW352.82 g/mol
LogP4.24
Rot. Bonds6

About 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide

3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 30155863) has the molecular formula C20H17ClN2O2 and a molecular weight of 352.82 g/mol. Its IUPAC name is 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide
PubChem CID30155863
Molecular FormulaC20H17ClN2O2
Molecular Weight352.82 g/mol
Exact Mass352.10
IUPAC Name3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide
SMILESO=C(NCc1ccncc1)c1cccc(OCc2ccccc2Cl)c1
InChIInChI=1S/C20H17ClN2O2/c21-19-7-2-1-4-17(19)14-25-18-6-3-5-16(12-18)20(24)23-13-15-8-10-22-11-9-15/h1-12H,13-14H2,(H,23,24)
InChIKeyHVXJGVKXQBQXQH-UHFFFAOYSA-N
XLogP4.24
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.82
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chlorophenyl)methyl]-3-(pyridin-3-ylmethoxy)benzamide
CID 55772208
3-[(2-chlorophenyl)methoxy]-N-prop-2-enylbenzamide
CID 30155712
N-[(2-chlorophenyl)methyl]-3-ethoxybenzamide
CID 2971835
3-N-(2-chlorophenyl)-1-N-(pyridin-4-ylmethyl)benzene-1,3-dicarboxamide
CID 109055210
3-(2-amino-2-oxoethoxy)-N-[(2-chlorophenyl)methyl]benzamide
CID 35558245
3-[(2-chlorophenyl)methoxy]-N-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]benzamide
CID 100750231
3-[(2-chlorophenyl)methoxy]-N-(3-methoxyphenyl)benzamide
CID 30155561
N-benzyl-3-[2-(2-chlorophenoxy)ethoxy]benzamide
CID 7492331
N-[(2-chlorophenyl)methyl]-3-methoxybenzamide
CID 790117
3-[(2-chlorophenyl)methoxy]-N,N-dimethylbenzamide
CID 13176467
3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 30155523
N-[(2-chlorophenyl)methyl]-3-(2-methylprop-2-enoxy)benzamide
CID 17194215

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide?
The IUPAC name of 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide (CID 30155863) is 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide is O=C(NCc1ccncc1)c1cccc(OCc2ccccc2Cl)c1.
What is the InChIKey of 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is HVXJGVKXQBQXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O2/c21-19-7-2-1-4-17(19)14-25-18-6-3-5-16(12-18)20(24)23-13-15-8-10-22-11-9-15/h1-12H,13-14H2,(H,23,24).
What are the key properties of 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide?
3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide has a molecular weight of 352.82 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chlorophenyl)methoxy]-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 30155863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).