5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide

C14H16N4O — CID 114405125

IUPAC5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)c1nc(C(N)=O)ccc1N
InChIInChI=1S/C14H16N4O/c1-18(9-10-5-3-2-4-6-10)14-11(15)7-8-12(17-14)13(16)19/h2-8H,9,15H2,1H3,(H2,16,19)
InChIKeyXFOFJDRNNFOCHM-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.40
Rot. Bonds4

About 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide

5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide (PubChem CID 114405125) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide
PubChem CID114405125
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide
SMILESCN(Cc1ccccc1)c1nc(C(N)=O)ccc1N
InChIInChI=1S/C14H16N4O/c1-18(9-10-5-3-2-4-6-10)14-11(15)7-8-12(17-14)13(16)19/h2-8H,9,15H2,1H3,(H2,16,19)
InChIKeyXFOFJDRNNFOCHM-UHFFFAOYSA-N
XLogP1.40
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-benzyl-6-chloro-2-N-methylpyridine-2,3-diamine
CID 115473524
5-amino-6-[(4-bromophenyl)methyl-methylamino]pyridine-2-carboxylic acid
CID 114405667
2-N-benzyl-2-N,6-dimethylpyridine-2,3-diamine
CID 79020868
methyl 5-amino-6-[methyl(pyridin-4-ylmethyl)amino]pyridine-2-carboxylate
CID 114405544
5-amino-6-[cyclopropyl(methyl)amino]pyridine-2-carboxamide
CID 114405386
5-amino-6-[methyl(pentan-2-yl)amino]pyridine-2-carboxamide
CID 114405541
methyl 5-amino-6-[methyl(pyridin-2-ylmethyl)amino]pyridine-2-carboxylate
CID 114405521
5-amino-6-[cyclopentyl(methyl)amino]pyridine-2-carboxamide
CID 114405392
5-amino-6-benzylsulfanylpyridine-2-carboxamide
CID 114409310
5-amino-6-phenylmethoxypyridine-2-carboxamide
CID 114408377
5-amino-6-(N-ethyl-2-fluoroanilino)pyridine-2-carboxamide
CID 114406299
5-amino-6-[methyl(1,3-thiazol-4-ylmethyl)amino]pyridine-2-carboxylic acid
CID 114406127

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide?
The IUPAC name of 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide (CID 114405125) is 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide is CN(Cc1ccccc1)c1nc(C(N)=O)ccc1N.
What is the InChIKey of 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide?
The InChIKey is XFOFJDRNNFOCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-18(9-10-5-3-2-4-6-10)14-11(15)7-8-12(17-14)13(16)19/h2-8H,9,15H2,1H3,(H2,16,19).
What are the key properties of 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide?
5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[benzyl(methyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 114405125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).