2-methyl-N-(3-phenylcyclobutyl)propanamide

C14H19NO — CID 166834731

IUPAC2-methyl-N-(3-phenylcyclobutyl)propanamide
SMILESCC(C)C(=O)NC1CC(c2ccccc2)C1
InChIInChI=1S/C14H19NO/c1-10(2)14(16)15-13-8-12(9-13)11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3,(H,15,16)
InChIKeyCMOLNKGESMCZDX-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.70
Rot. Bonds3

About 2-methyl-N-(3-phenylcyclobutyl)propanamide

2-methyl-N-(3-phenylcyclobutyl)propanamide (PubChem CID 166834731) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-methyl-N-(3-phenylcyclobutyl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(3-phenylcyclobutyl)propanamide
PubChem CID166834731
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-methyl-N-(3-phenylcyclobutyl)propanamide
SMILESCC(C)C(=O)NC1CC(c2ccccc2)C1
InChIInChI=1S/C14H19NO/c1-10(2)14(16)15-13-8-12(9-13)11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3,(H,15,16)
InChIKeyCMOLNKGESMCZDX-UHFFFAOYSA-N
XLogP2.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-phenylcyclobutyl)propanamide?
The IUPAC name of 2-methyl-N-(3-phenylcyclobutyl)propanamide (CID 166834731) is 2-methyl-N-(3-phenylcyclobutyl)propanamide.
What is the SMILES notation for 2-methyl-N-(3-phenylcyclobutyl)propanamide?
The canonical SMILES for 2-methyl-N-(3-phenylcyclobutyl)propanamide is CC(C)C(=O)NC1CC(c2ccccc2)C1.
What is the InChIKey of 2-methyl-N-(3-phenylcyclobutyl)propanamide?
The InChIKey is CMOLNKGESMCZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10(2)14(16)15-13-8-12(9-13)11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3,(H,15,16).
What are the key properties of 2-methyl-N-(3-phenylcyclobutyl)propanamide?
2-methyl-N-(3-phenylcyclobutyl)propanamide has a molecular weight of 217.31 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-phenylcyclobutyl)propanamide is sourced from PubChem (CID 166834731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).