2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide

C14H15N3O2 — CID 55138314

IUPAC2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cccnc2N)c(C)c1
InChIInChI=1S/C14H15N3O2/c1-9-8-10(19-2)5-6-12(9)17-14(18)11-4-3-7-16-13(11)15/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyWYFSDACZFCJOEU-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.23
Rot. Bonds3

About 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide

2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide (PubChem CID 55138314) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide
PubChem CID55138314
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cccnc2N)c(C)c1
InChIInChI=1S/C14H15N3O2/c1-9-8-10(19-2)5-6-12(9)17-14(18)11-4-3-7-16-13(11)15/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyWYFSDACZFCJOEU-UHFFFAOYSA-N
XLogP2.23
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide (CID 55138314) is 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide is COc1ccc(NC(=O)c2cccnc2N)c(C)c1.
What is the InChIKey of 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is WYFSDACZFCJOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9-8-10(19-2)5-6-12(9)17-14(18)11-4-3-7-16-13(11)15/h3-8H,1-2H3,(H2,15,16)(H,17,18).
What are the key properties of 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide?
2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-methoxy-2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 55138314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).