2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide

C14H14ClN3O2 — CID 103293349

IUPAC2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide
SMILESCOc1cccc(Cl)c1CNC(=O)c1ccnc(N)c1
InChIInChI=1S/C14H14ClN3O2/c1-20-12-4-2-3-11(15)10(12)8-18-14(19)9-5-6-17-13(16)7-9/h2-7H,8H2,1H3,(H2,16,17)(H,18,19)
InChIKeyYIOOXYAFZJKYMH-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.26
Rot. Bonds4

About 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide

2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide (PubChem CID 103293349) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide
PubChem CID103293349
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide
SMILESCOc1cccc(Cl)c1CNC(=O)c1ccnc(N)c1
InChIInChI=1S/C14H14ClN3O2/c1-20-12-4-2-3-11(15)10(12)8-18-14(19)9-5-6-17-13(16)7-9/h2-7H,8H2,1H3,(H2,16,17)(H,18,19)
InChIKeyYIOOXYAFZJKYMH-UHFFFAOYSA-N
XLogP2.26
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 103293340
N-[(2-chloro-6-methoxyphenyl)methyl]-3-iodobenzamide
CID 103292680
N-[(2-chloro-6-methoxyphenyl)methyl]-3-sulfanylbenzamide
CID 107037038
N-[(2-chloro-6-methoxyphenyl)methyl]-4-hydroxy-3-methylbenzamide
CID 103528255
2-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 106262018
3-bromo-5-chloro-N-[(2-chloro-6-methoxyphenyl)methyl]benzamide
CID 107953670
methyl N-[(2-chloro-6-methoxyphenyl)methyl]carbamate
CID 103292136
1-amino-3-[(2-chloro-6-methoxyphenyl)methyl]urea
CID 103293245
N-[(2-chloro-6-methoxyphenyl)methyl]-1,3-thiazole-4-carboxamide
CID 103292671
N-[(2-chloro-6-methoxyphenyl)methyl]-5-hydrazinylpyrazine-2-carboxamide
CID 107378745
2-amino-N-(3-chloro-4-methoxyphenyl)pyridine-4-carboxamide
CID 55043717
N-[(2-chloro-6-methoxyphenyl)methyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 99834698

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide (CID 103293349) is 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide is COc1cccc(Cl)c1CNC(=O)c1ccnc(N)c1.
What is the InChIKey of 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide?
The InChIKey is YIOOXYAFZJKYMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-20-12-4-2-3-11(15)10(12)8-18-14(19)9-5-6-17-13(16)7-9/h2-7H,8H2,1H3,(H2,16,17)(H,18,19).
What are the key properties of 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide?
2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 103293349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).