2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide

C16H18N2O3 — CID 84580740

IUPAC2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCOc1ccc(C(C)NC(=O)c2cccnc2OC)cc1
InChIInChI=1S/C16H18N2O3/c1-11(12-6-8-13(20-2)9-7-12)18-15(19)14-5-4-10-17-16(14)21-3/h4-11H,1-3H3,(H,18,19)
InChIKeyWRRZVMXGFGUVHK-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.59
Rot. Bonds5

About 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide

2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 84580740) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
PubChem CID84580740
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCOc1ccc(C(C)NC(=O)c2cccnc2OC)cc1
InChIInChI=1S/C16H18N2O3/c1-11(12-6-8-13(20-2)9-7-12)18-15(19)14-5-4-10-17-16(14)21-3/h4-11H,1-3H3,(H,18,19)
InChIKeyWRRZVMXGFGUVHK-UHFFFAOYSA-N
XLogP2.59
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[4-(aminomethyl)phenyl]ethyl]-2-methoxypyridine-3-carboxamide
CID 62876323
N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-(methylamino)benzamide
CID 81368855
N-[(1S)-1-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 39853258
2-chloro-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 976730
2-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 962592
2-iodo-N-[1-(4-methoxyphenyl)ethyl]benzamide
CID 3389695
2,3-difluoro-N-[1-(4-methoxyphenyl)ethyl]benzamide
CID 62865993
3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid
CID 43360879
N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-methylsulfanylbenzamide
CID 92683618
3-[(2-methoxypyridine-3-carbonyl)amino]-2-methylbutanoic acid
CID 113415816
N-(4-hydroxypentan-2-yl)-2-methoxypyridine-3-carboxamide
CID 113376564
N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-(trifluoromethyl)benzamide
CID 28560281

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide (CID 84580740) is 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide is COc1ccc(C(C)NC(=O)c2cccnc2OC)cc1.
What is the InChIKey of 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is WRRZVMXGFGUVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11(12-6-8-13(20-2)9-7-12)18-15(19)14-5-4-10-17-16(14)21-3/h4-11H,1-3H3,(H,18,19).
What are the key properties of 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide?
2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 84580740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).