5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide

C15H18N4O — CID 61413892

IUPAC5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide
SMILESCc1cccc(CN(C)c2ncc(N)cc2C(N)=O)c1
InChIInChI=1S/C15H18N4O/c1-10-4-3-5-11(6-10)9-19(2)15-13(14(17)20)7-12(16)8-18-15/h3-8H,9,16H2,1-2H3,(H2,17,20)
InChIKeyFNFYAALJNMLRBH-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.71
Rot. Bonds4

About 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide

5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide (PubChem CID 61413892) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide
PubChem CID61413892
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide
SMILESCc1cccc(CN(C)c2ncc(N)cc2C(N)=O)c1
InChIInChI=1S/C15H18N4O/c1-10-4-3-5-11(6-10)9-19(2)15-13(14(17)20)7-12(16)8-18-15/h3-8H,9,16H2,1-2H3,(H2,17,20)
InChIKeyFNFYAALJNMLRBH-UHFFFAOYSA-N
XLogP1.71
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-[(3-cyanophenyl)methyl-methylamino]pyridine-3-carboxamide
CID 62983154
5-amino-2-[methyl-[(2-methylphenyl)methyl]amino]pyridine-3-carboxamide
CID 61359375
5-amino-2-[benzyl(methyl)amino]pyridine-3-carboxylic acid
CID 82482899
3-amino-2-[methyl-[(3-methylphenyl)methyl]amino]benzamide
CID 115934261
5-amino-2-[methyl(propyl)amino]pyridine-3-carboxamide
CID 61358399
5-amino-2-[methyl(pentyl)amino]pyridine-3-carboxamide
CID 61358598
2-N-methyl-2-N-[(3-methylphenyl)methyl]pyridine-2,3-diamine
CID 61414258
5-amino-2-[5-hydroxypentyl(methyl)amino]pyridine-3-carboxamide
CID 107197717
5-amino-2-(diethylamino)pyridine-3-carboxamide
CID 61359746
5-(aminomethyl)-3-chloro-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine
CID 62285878
2-N-benzyl-3-chloro-2-N-methylpyridine-2,5-diamine
CID 82480063
5-amino-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]pyridine-3-carboxamide
CID 55005406

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide (CID 61413892) is 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide is Cc1cccc(CN(C)c2ncc(N)cc2C(N)=O)c1.
What is the InChIKey of 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide?
The InChIKey is FNFYAALJNMLRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-10-4-3-5-11(6-10)9-19(2)15-13(14(17)20)7-12(16)8-18-15/h3-8H,9,16H2,1-2H3,(H2,17,20).
What are the key properties of 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide?
5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[methyl-[(3-methylphenyl)methyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 61413892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).