N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide

C16H19N3O2 — CID 62166611

IUPACN-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C16H19N3O2/c1-3-9-17-15-14(8-5-10-18-15)16(20)19-12-6-4-7-13(11-12)21-2/h4-8,10-11H,3,9H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyKGPIMFHMTZQQBE-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.16
Rot. Bonds6

About N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide

N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide (PubChem CID 62166611) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide
PubChem CID62166611
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C16H19N3O2/c1-3-9-17-15-14(8-5-10-18-15)16(20)19-12-6-4-7-13(11-12)21-2/h4-8,10-11H,3,9H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyKGPIMFHMTZQQBE-UHFFFAOYSA-N
XLogP3.16
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide (CID 62166611) is N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide is CCCNc1ncccc1C(=O)Nc1cccc(OC)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide?
The InChIKey is KGPIMFHMTZQQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-9-17-15-14(8-5-10-18-15)16(20)19-12-6-4-7-13(11-12)21-2/h4-8,10-11H,3,9H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide?
N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62166611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).