5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide

C20H17ClN2O2 — CID 6463802

IUPAC5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1cc(Cl)ccc1OCc1ccccc1
InChIInChI=1S/C20H17ClN2O2/c21-16-9-10-19(25-14-15-6-2-1-3-7-15)18(12-16)20(24)23-13-17-8-4-5-11-22-17/h1-12H,13-14H2,(H,23,24)
InChIKeyIRBKDRWQBJCKRY-UHFFFAOYSA-N
MW352.82 g/mol
LogP4.24
Rot. Bonds6

About 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide

5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 6463802) has the molecular formula C20H17ClN2O2 and a molecular weight of 352.82 g/mol. Its IUPAC name is 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide
PubChem CID6463802
Molecular FormulaC20H17ClN2O2
Molecular Weight352.82 g/mol
Exact Mass352.10
IUPAC Name5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1cc(Cl)ccc1OCc1ccccc1
InChIInChI=1S/C20H17ClN2O2/c21-16-9-10-19(25-14-15-6-2-1-3-7-15)18(12-16)20(24)23-13-17-8-4-5-11-22-17/h1-12H,13-14H2,(H,23,24)
InChIKeyIRBKDRWQBJCKRY-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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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide (CID 6463802) is 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide is O=C(NCc1ccccn1)c1cc(Cl)ccc1OCc1ccccc1.
What is the InChIKey of 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is IRBKDRWQBJCKRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O2/c21-16-9-10-19(25-14-15-6-2-1-3-7-15)18(12-16)20(24)23-13-17-8-4-5-11-22-17/h1-12H,13-14H2,(H,23,24).
What are the key properties of 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide?
5-chloro-2-phenylmethoxy-N-(pyridin-2-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 5-chloro-2-phenylmethoxy-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 6463802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).