5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide

C14H16N4O2 — CID 61357803

IUPAC5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccccc1CNc1ncc(N)cc1C(N)=O
InChIInChI=1S/C14H16N4O2/c1-20-12-5-3-2-4-9(12)7-17-14-11(13(16)19)6-10(15)8-18-14/h2-6,8H,7,15H2,1H3,(H2,16,19)(H,17,18)
InChIKeyPRVBLWQJOHBKLY-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.38
Rot. Bonds5

About 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide

5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide (PubChem CID 61357803) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
PubChem CID61357803
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccccc1CNc1ncc(N)cc1C(N)=O
InChIInChI=1S/C14H16N4O2/c1-20-12-5-3-2-4-9(12)7-17-14-11(13(16)19)6-10(15)8-18-14/h2-6,8H,7,15H2,1H3,(H2,16,19)(H,17,18)
InChIKeyPRVBLWQJOHBKLY-UHFFFAOYSA-N
XLogP1.38
TPSA103.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-2-[(2-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 61358389
5-amino-2-(pyridin-2-ylmethylamino)pyridine-3-carboxamide
CID 61359752
5-amino-2-(ethylamino)pyridine-3-carboxamide
CID 61357419
3-amino-4-[(2-methoxyphenyl)methylamino]benzamide
CID 43448336
4-amino-3-[(2-methoxyphenyl)methylamino]benzamide
CID 63355954
5-amino-2-[(1,3-dimethylpyrazol-4-yl)methylamino]pyridine-3-carboxamide
CID 112668337
5-amino-2-[(5-methylthiophen-2-yl)methylamino]pyridine-3-carboxamide
CID 62057948
2-[(5-amino-2-methoxyphenyl)methylamino]benzamide
CID 61015082
3-[(2-methoxyphenyl)methylamino]pyridazine-4-carbothioamide
CID 80510898
2-[2-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 43738441
5-amino-2-(4-bromo-3-methoxyanilino)pyridine-3-carboxamide
CID 82857322
2-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-5-nitropyridine-3-carboxamide
CID 94178776

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide (CID 61357803) is 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide is COc1ccccc1CNc1ncc(N)cc1C(N)=O.
What is the InChIKey of 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is PRVBLWQJOHBKLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-20-12-5-3-2-4-9(12)7-17-14-11(13(16)19)6-10(15)8-18-14/h2-6,8H,7,15H2,1H3,(H2,16,19)(H,17,18).
What are the key properties of 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.38, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 61357803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).