5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide

C15H15ClN2O2 — CID 56827227

IUPAC5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide
SMILESCCN(C(=O)c1cc(Cl)ccc1OC)c1cccnc1
InChIInChI=1S/C15H15ClN2O2/c1-3-18(12-5-4-8-17-10-12)15(19)13-9-11(16)6-7-14(13)20-2/h4-10H,3H2,1-2H3
InChIKeyUOMPNLWDUYHDLA-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.41
Rot. Bonds4

About 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide

5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide (PubChem CID 56827227) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide
PubChem CID56827227
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide
SMILESCCN(C(=O)c1cc(Cl)ccc1OC)c1cccnc1
InChIInChI=1S/C15H15ClN2O2/c1-3-18(12-5-4-8-17-10-12)15(19)13-9-11(16)6-7-14(13)20-2/h4-10H,3H2,1-2H3
InChIKeyUOMPNLWDUYHDLA-UHFFFAOYSA-N
XLogP3.41
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminophenyl)-4-chloro-N-ethyl-2-methoxybenzamide
CID 63229751
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 43966998
5-chloro-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 43967002
5-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 43967001
2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide
CID 46194702
2,5-dichloro-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 40996119
N-(2-bromoethyl)-5-chloro-N-ethyl-2-methoxybenzamide
CID 80661232
1-[(5-chloro-2-methoxybenzoyl)-(1,1,1-trifluorobutan-2-yl)amino]-1-(1,1,1-trifluorobutan-2-yl)urea
CID 87692796
5-amino-N-ethyl-2-methoxy-N-(3-methylphenyl)benzamide
CID 61104661
1-N,1-N,4-N-triethyl-4-N-pyridin-3-ylbenzene-1,4-dicarboxamide
CID 46932084
2,5-dichloro-N-ethyl-N-(3-hydroxyphenyl)benzamide
CID 107736182
5-chloro-2-iodo-N-methyl-N-pyridin-3-ylbenzamide
CID 113236277

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide?
The IUPAC name of 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide (CID 56827227) is 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide?
The canonical SMILES for 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide is CCN(C(=O)c1cc(Cl)ccc1OC)c1cccnc1.
What is the InChIKey of 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide?
The InChIKey is UOMPNLWDUYHDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-3-18(12-5-4-8-17-10-12)15(19)13-9-11(16)6-7-14(13)20-2/h4-10H,3H2,1-2H3.
What are the key properties of 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide?
5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide has a molecular weight of 290.75 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-2-methoxy-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 56827227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).