2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide

C13H24N2O — CID 104963390

IUPAC2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)C(C)C2CNC2)CC1
InChIInChI=1S/C13H24N2O/c1-9-3-5-12(6-4-9)15-13(16)10(2)11-7-14-8-11/h9-12,14H,3-8H2,1-2H3,(H,15,16)
InChIKeyVNEGFZRJPBRRNY-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.54
Rot. Bonds3

About 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide

2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide (PubChem CID 104963390) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide
PubChem CID104963390
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)C(C)C2CNC2)CC1
InChIInChI=1S/C13H24N2O/c1-9-3-5-12(6-4-9)15-13(16)10(2)11-7-14-8-11/h9-12,14H,3-8H2,1-2H3,(H,15,16)
InChIKeyVNEGFZRJPBRRNY-UHFFFAOYSA-N
XLogP1.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide 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-(azetidin-3-yl)-N-cyclopentylpropanamide
CID 116674243
2-(azetidin-3-yl)-N-[3-(cyclopropylamino)-3-oxopropyl]propanamide
CID 116678382
2-(azetidin-3-yl)-N-(thiolan-3-yl)propanamide
CID 103063076
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-cyclopropylpropanamide
CID 83148051
(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide
CID 70253137
N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide
CID 81044327
2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide
CID 116674271
2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide
CID 116676307
N-cyclopropylacetamide;1-methyl-4-propan-2-ylcyclohexane
CID 90040795
N-(4-methylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981352
2-(azetidin-3-yl)-N-(2-tert-butylcyclohexyl)propanamide
CID 116675144
2-(azetidin-3-yl)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]propanamide
CID 107852972

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide (CID 104963390) is 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide is CC1CCC(NC(=O)C(C)C2CNC2)CC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide?
The InChIKey is VNEGFZRJPBRRNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-9-3-5-12(6-4-9)15-13(16)10(2)11-7-14-8-11/h9-12,14H,3-8H2,1-2H3,(H,15,16).
What are the key properties of 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide?
2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide has a molecular weight of 224.35 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(4-methylcyclohexyl)propanamide is sourced from PubChem (CID 104963390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).