2-[2-(3-methylphenyl)cyclopropyl]propanamide

C13H17NO — CID 67553478

IUPAC2-[2-(3-methylphenyl)cyclopropyl]propanamide
SMILESCc1cccc(C2CC2C(C)C(N)=O)c1
InChIInChI=1S/C13H17NO/c1-8-4-3-5-10(6-8)12-7-11(12)9(2)13(14)15/h3-6,9,11-12H,7H2,1-2H3,(H2,14,15)
InChIKeyPWCKMYMURNVAGV-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.22
Rot. Bonds3

About 2-[2-(3-methylphenyl)cyclopropyl]propanamide

2-[2-(3-methylphenyl)cyclopropyl]propanamide (PubChem CID 67553478) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-[2-(3-methylphenyl)cyclopropyl]propanamide.

Molecular Properties

Compound Name2-[2-(3-methylphenyl)cyclopropyl]propanamide
PubChem CID67553478
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Name2-[2-(3-methylphenyl)cyclopropyl]propanamide
SMILESCc1cccc(C2CC2C(C)C(N)=O)c1
InChIInChI=1S/C13H17NO/c1-8-4-3-5-10(6-8)12-7-11(12)9(2)13(14)15/h3-6,9,11-12H,7H2,1-2H3,(H2,14,15)
InChIKeyPWCKMYMURNVAGV-UHFFFAOYSA-N
XLogP2.22
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-[(1S,2S)-2-(3-methylphenyl)cyclopropyl]ethanamine
CID 28912202
trans-(1S,2S)-2-(3-methylphenyl)cyclopropane-1-carboxylic acid
CID 28912189
trans-(1R,2S)-2-(3-methylphenyl)cyclopropan-1-amine;hydrochloride
CID 170914369
6-methyl-N-[(1S)-1-[(1R,2R)-2-(3-methylphenyl)cyclopropyl]ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 98768691
8-methyl-3-(3-methylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylic acid
CID 91199321
(2S)-2-(methoxymethyl)-N-[(1R)-1-[(1R,2S)-2-(3-methylphenyl)cyclopropyl]ethyl]morpholine-4-carboxamide
CID 97219077
(2S)-2-(methoxymethyl)-N-[(1R)-1-[(1S,2S)-2-(3-methylphenyl)cyclopropyl]ethyl]morpholine-4-carboxamide
CID 97219075
[(3-methylphenyl)-(2-phenylcyclopropyl)methyl]hydrazine
CID 105200887
methyl (2S,5R)-8-methyl-3-(3-methylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
CID 59919798
1-methyl-3-[(1S,2S)-2-(trifluoromethyl)cyclopropyl]benzene
CID 102579240
trans-(1S,2R)-2-(3-methylphenyl)cyclohexan-1-ol
CID 36688903
N-methyl-2-(3-methylphenyl)cyclopropan-1-amine
CID 83694830

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylphenyl)cyclopropyl]propanamide?
The IUPAC name of 2-[2-(3-methylphenyl)cyclopropyl]propanamide (CID 67553478) is 2-[2-(3-methylphenyl)cyclopropyl]propanamide.
What is the SMILES notation for 2-[2-(3-methylphenyl)cyclopropyl]propanamide?
The canonical SMILES for 2-[2-(3-methylphenyl)cyclopropyl]propanamide is Cc1cccc(C2CC2C(C)C(N)=O)c1.
What is the InChIKey of 2-[2-(3-methylphenyl)cyclopropyl]propanamide?
The InChIKey is PWCKMYMURNVAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-8-4-3-5-10(6-8)12-7-11(12)9(2)13(14)15/h3-6,9,11-12H,7H2,1-2H3,(H2,14,15).
What are the key properties of 2-[2-(3-methylphenyl)cyclopropyl]propanamide?
2-[2-(3-methylphenyl)cyclopropyl]propanamide has a molecular weight of 203.29 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylphenyl)cyclopropyl]propanamide is sourced from PubChem (CID 67553478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).