6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide

C14H15N3O — CID 62059203

IUPAC6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(N)nc2)c1
InChIInChI=1S/C14H15N3O/c1-9-5-10(2)7-12(6-9)17-14(18)11-3-4-13(15)16-8-11/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyBLYXQCXSUOQSMW-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.53
Rot. Bonds2

About 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide

6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide (PubChem CID 62059203) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
PubChem CID62059203
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(N)nc2)c1
InChIInChI=1S/C14H15N3O/c1-9-5-10(2)7-12(6-9)17-14(18)11-3-4-13(15)16-8-11/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyBLYXQCXSUOQSMW-UHFFFAOYSA-N
XLogP2.53
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide (CID 62059203) is 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide is Cc1cc(C)cc(NC(=O)c2ccc(N)nc2)c1.
What is the InChIKey of 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide?
The InChIKey is BLYXQCXSUOQSMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-5-10(2)7-12(6-9)17-14(18)11-3-4-13(15)16-8-11/h3-8H,1-2H3,(H2,15,16)(H,17,18).
What are the key properties of 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide?
6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 2.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3,5-dimethylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62059203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).