6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide

C15H23N3O3 — CID 142430003

IUPAC6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide
SMILESCCC(=O)NCCNC(=O)c1ccc(OCC(C)C)nc1
InChIInChI=1S/C15H23N3O3/c1-4-13(19)16-7-8-17-15(20)12-5-6-14(18-9-12)21-10-11(2)3/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyPEONWIFKPUEIRB-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.37
Rot. Bonds8

About 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide

6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide (PubChem CID 142430003) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide
PubChem CID142430003
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide
SMILESCCC(=O)NCCNC(=O)c1ccc(OCC(C)C)nc1
InChIInChI=1S/C15H23N3O3/c1-4-13(19)16-7-8-17-15(20)12-5-6-14(18-9-12)21-10-11(2)3/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyPEONWIFKPUEIRB-UHFFFAOYSA-N
XLogP1.37
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-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

N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]-6-(2-methylpropoxy)pyridine-3-carboxamide
CID 47068402
6-fluoro-N-[2-(2-methylpropoxy)ethyl]pyridine-3-carboxamide
CID 115627193
N-(3-hydroxy-4-methoxybutyl)-6-methoxypyridine-3-carboxamide
CID 103877604
4-[(6-propan-2-yloxypyridine-3-carbonyl)amino]butanoic acid
CID 119137026
N-(3-butoxypropyl)-6-ethoxypyridine-3-carboxamide
CID 87002141
4-(2-methylpropoxy)-N-[3-[[4-(2-methylpropoxy)benzoyl]amino]propyl]benzamide
CID 4938333
6-(2-methylpropoxy)-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 121177832
4-(propanoylamino)-N-[2-(propanoylamino)ethyl]benzamide
CID 121062260
3,4-dimethyl-N-[2-(propanoylamino)ethyl]benzamide
CID 108542747
4-(2-methylpropoxy)-N-[8-[[4-(2-methylpropoxy)benzoyl]amino]octyl]benzamide
CID 17233376
N-[1-oxo-1-(propylamino)propan-2-yl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 42933993
(2S)-4-methyl-2-[[2-[(6-propan-2-yloxypyridine-3-carbonyl)amino]acetyl]amino]pentanoic acid
CID 120694902

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide (CID 142430003) is 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide is CCC(=O)NCCNC(=O)c1ccc(OCC(C)C)nc1.
What is the InChIKey of 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide?
The InChIKey is PEONWIFKPUEIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-4-13(19)16-7-8-17-15(20)12-5-6-14(18-9-12)21-10-11(2)3/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,16,19)(H,17,20).
What are the key properties of 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide?
6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.37, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylpropoxy)-N-[2-(propanoylamino)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 142430003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).