N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide

C17H20N2O2 — CID 24512570

IUPACN-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1cccnc1Oc1ccccc1
InChIInChI=1S/C17H20N2O2/c1-13(2)10-12-18-16(20)15-9-6-11-19-17(15)21-14-7-4-3-5-8-14/h3-9,11,13H,10,12H2,1-2H3,(H,18,20)
InChIKeyCBIQSMHRIYAMTH-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.65
Rot. Bonds6

About N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide

N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide (PubChem CID 24512570) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide
PubChem CID24512570
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1cccnc1Oc1ccccc1
InChIInChI=1S/C17H20N2O2/c1-13(2)10-12-18-16(20)15-9-6-11-19-17(15)21-14-7-4-3-5-8-14/h3-9,11,13H,10,12H2,1-2H3,(H,18,20)
InChIKeyCBIQSMHRIYAMTH-UHFFFAOYSA-N
XLogP3.65
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-(ethylsulfonylamino)phenoxy]-N-(3-methylbutyl)pyridine-3-carboxamide
CID 53117628
N-(3-hydroxybutyl)-2-(2-methylpropoxy)pyridine-3-carboxamide
CID 111429038
2-phenoxy-N-[3-(2-phenylethoxy)propyl]pyridine-3-carboxamide
CID 55889564
2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 35138227
N-(2-methylpropyl)-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide
CID 59374131
N-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-2-phenoxypyridine-3-carboxamide
CID 55723951
N-[(2S)-2-(dimethylamino)propyl]-2-pyridin-3-yloxypyridine-3-carboxamide
CID 95286023
N-(4-methoxyphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513637
2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 22170733
N-[[(2S)-oxolan-2-yl]methyl]-2-phenoxypyridine-3-carboxamide
CID 32688545
N-(2-hydroxyethyl)-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide
CID 59374271
2-chloro-N-(3-methylbutyl)benzamide
CID 669760

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide?
The IUPAC name of N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide (CID 24512570) is N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide is CC(C)CCNC(=O)c1cccnc1Oc1ccccc1.
What is the InChIKey of N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide?
The InChIKey is CBIQSMHRIYAMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-13(2)10-12-18-16(20)15-9-6-11-19-17(15)21-14-7-4-3-5-8-14/h3-9,11,13H,10,12H2,1-2H3,(H,18,20).
What are the key properties of N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide?
N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 24512570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).