N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide

C14H15N3O2 — CID 104640036

IUPACN-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2cccc(OC)c2)nc1
InChIInChI=1S/C14H15N3O2/c1-15-11-6-7-13(16-9-11)14(18)17-10-4-3-5-12(8-10)19-2/h3-9,15H,1-2H3,(H,17,18)
InChIKeyHRJNZLPQZXYKMS-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.38
Rot. Bonds4

About N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide

N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide (PubChem CID 104640036) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
PubChem CID104640036
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2cccc(OC)c2)nc1
InChIInChI=1S/C14H15N3O2/c1-15-11-6-7-13(16-9-11)14(18)17-10-4-3-5-12(8-10)19-2/h3-9,15H,1-2H3,(H,17,18)
InChIKeyHRJNZLPQZXYKMS-UHFFFAOYSA-N
XLogP2.38
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide (CID 104640036) is N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide is CNc1ccc(C(=O)Nc2cccc(OC)c2)nc1.
What is the InChIKey of N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide?
The InChIKey is HRJNZLPQZXYKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-15-11-6-7-13(16-9-11)14(18)17-10-4-3-5-12(8-10)19-2/h3-9,15H,1-2H3,(H,17,18).
What are the key properties of N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide?
N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104640036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).