4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide

C16H17ClN2O2 — CID 81227998

IUPAC4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide
SMILESCCOCc1ccccc1NC(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C16H17ClN2O2/c1-3-21-10-12-6-4-5-7-15(12)19-16(20)13-9-18-11(2)8-14(13)17/h4-9H,3,10H2,1-2H3,(H,19,20)
InChIKeyZBZKSEQEYCHQSW-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.83
Rot. Bonds5

About 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide

4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide (PubChem CID 81227998) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide
PubChem CID81227998
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide
SMILESCCOCc1ccccc1NC(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C16H17ClN2O2/c1-3-21-10-12-6-4-5-7-15(12)19-16(20)13-9-18-11(2)8-14(13)17/h4-9H,3,10H2,1-2H3,(H,19,20)
InChIKeyZBZKSEQEYCHQSW-UHFFFAOYSA-N
XLogP3.83
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-6-methyl-N-(2-propylphenyl)pyridine-3-carboxamide
CID 81226564
4-chloro-N-[2-[(dimethylamino)methyl]phenyl]-6-methylpyridine-3-carboxamide
CID 81227997
N-[2-(ethoxymethyl)phenyl]-2,4-dimethylbenzamide
CID 86821681
N-[2-(ethoxymethyl)phenyl]-3,4-dimethylbenzamide
CID 86821684
N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81236414
N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide
CID 62511294
N-[2-(ethoxymethyl)phenyl]-2H-triazole-4-carboxamide
CID 47361062
4-chloro-N-[(2-hydroxyphenyl)methyl]-6-methylpyridine-3-carboxamide
CID 114331675
N-[2-(ethoxymethyl)phenyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 86821819
2-(2,4-dichlorophenoxy)-N-[2-(ethoxymethyl)phenyl]acetamide
CID 86821663
4-chloro-6-methyl-N-quinolin-5-ylpyridine-3-carboxamide
CID 81230952
N-(2-chlorophenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81236485

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide (CID 81227998) is 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide is CCOCc1ccccc1NC(=O)c1cnc(C)cc1Cl.
What is the InChIKey of 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide?
The InChIKey is ZBZKSEQEYCHQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-3-21-10-12-6-4-5-7-15(12)19-16(20)13-9-18-11(2)8-14(13)17/h4-9H,3,10H2,1-2H3,(H,19,20).
What are the key properties of 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide?
4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81227998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).