N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide

C21H19N3O3 — CID 7311959

IUPACN-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C21H19N3O3/c1-2-27-19-11-4-3-10-18(19)24-20(25)15-7-5-9-17(13-15)23-21(26)16-8-6-12-22-14-16/h3-14H,2H2,1H3,(H,23,26)(H,24,25)
InChIKeyNDYPMTYXVKWZDO-UHFFFAOYSA-N
MW361.40 g/mol
LogP3.98
Rot. Bonds6

About N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide

N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide (PubChem CID 7311959) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
PubChem CID7311959
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC NameN-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C21H19N3O3/c1-2-27-19-11-4-3-10-18(19)24-20(25)15-7-5-9-17(13-15)23-21(26)16-8-6-12-22-14-16/h3-14H,2H2,1H3,(H,23,26)(H,24,25)
InChIKeyNDYPMTYXVKWZDO-UHFFFAOYSA-N
XLogP3.98
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[2-(4-ethoxyphenoxy)phenyl]carbamoyl]phenyl]pyridine-3-carboxamide
CID 55630301
5-N-(2-ethoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108895
3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide
CID 35339665
N-(2-ethoxyphenyl)-3-[[4-(trifluoromethyl)benzoyl]amino]benzamide
CID 51049781
5-bromo-N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 55771323
2-[4-[3-(pyridine-3-carbonylamino)phenyl]piperazin-1-yl]ethyl N-(2-ethoxyphenyl)carbamate
CID 10345437
N-[3-[(3,4-dipropoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 55630389
N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925024
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
N-[3-[[[2-(2-methoxyanilino)acetyl]amino]carbamoyl]phenyl]pyridine-3-carboxamide
CID 55634332
1-N-(3-chlorophenyl)-4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 109049963
2-[[3-[(2-ethoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 2204072

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide (CID 7311959) is N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide is CCOc1ccccc1NC(=O)c1cccc(NC(=O)c2cccnc2)c1.
What is the InChIKey of N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide?
The InChIKey is NDYPMTYXVKWZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c1-2-27-19-11-4-3-10-18(19)24-20(25)15-7-5-9-17(13-15)23-21(26)16-8-6-12-22-14-16/h3-14H,2H2,1H3,(H,23,26)(H,24,25).
What are the key properties of N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide?
N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide has a molecular weight of 361.40 g/mol, XLogP of 3.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 7311959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).