5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide

C14H15N3O2 — CID 81320128

IUPAC5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(N)cn2)cc1
InChIInChI=1S/C14H15N3O2/c1-19-12-5-2-10(3-6-12)8-17-14(18)13-7-4-11(15)9-16-13/h2-7,9H,8,15H2,1H3,(H,17,18)
InChIKeyWZHRGIFMZZCYFZ-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.60
Rot. Bonds4

About 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide

5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide (PubChem CID 81320128) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
PubChem CID81320128
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(N)cn2)cc1
InChIInChI=1S/C14H15N3O2/c1-19-12-5-2-10(3-6-12)8-17-14(18)13-7-4-11(15)9-16-13/h2-7,9H,8,15H2,1H3,(H,17,18)
InChIKeyWZHRGIFMZZCYFZ-UHFFFAOYSA-N
XLogP1.60
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-methoxyphenyl)methyl]-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190354
N-[(4-methoxyphenyl)methyl]-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109190359
5-amino-N-[(4-sulfamoylphenyl)methyl]pyridine-2-carboxamide
CID 81310942
N-[(4-aminophenyl)methyl]-5-fluoropyridine-2-carboxamide
CID 113435772
5-(4-methoxyanilino)-N-[(4-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282451
5-(3,4-difluoroanilino)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109190451
5-amino-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 110851643
4-chloro-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 7802633
5-[(4-methoxyphenyl)methylamino]-N-propylpyridine-2-carboxamide
CID 109179073
5-(aminomethyl)-N-[(3-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 63724046
5-(3-fluoroanilino)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109190439
N-[(4-methoxyphenyl)methyl]-4-methylpyridine-2-carboxamide
CID 110851612

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide (CID 81320128) is 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide is COc1ccc(CNC(=O)c2ccc(N)cn2)cc1.
What is the InChIKey of 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?
The InChIKey is WZHRGIFMZZCYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-19-12-5-2-10(3-6-12)8-17-14(18)13-7-4-11(15)9-16-13/h2-7,9H,8,15H2,1H3,(H,17,18).
What are the key properties of 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?
5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 81320128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).