2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide

C15H21NO2 — CID 131913167

IUPAC2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide
SMILESCCC(OC)C(=O)NC1(c2ccccc2C)CC1
InChIInChI=1S/C15H21NO2/c1-4-13(18-3)14(17)16-15(9-10-15)12-8-6-5-7-11(12)2/h5-8,13H,4,9-10H2,1-3H3,(H,16,17)
InChIKeyRAWYBSVTHIDIQQ-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.53
Rot. Bonds5

About 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide

2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide (PubChem CID 131913167) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide
PubChem CID131913167
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide
SMILESCCC(OC)C(=O)NC1(c2ccccc2C)CC1
InChIInChI=1S/C15H21NO2/c1-4-13(18-3)14(17)16-15(9-10-15)12-8-6-5-7-11(12)2/h5-8,13H,4,9-10H2,1-3H3,(H,16,17)
InChIKeyRAWYBSVTHIDIQQ-UHFFFAOYSA-N
XLogP2.53
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2-methoxybutanoylamino)-2-phenylacetic acid
CID 119367809
N-[1-(2-chlorophenyl)cyclopropyl]-2-pyrrolidin-1-ylbutanamide
CID 118774266
1-[1-(2-aminophenyl)cyclopropyl]-3-butan-2-ylurea
CID 110491079
N-[1-(2-methylphenyl)cyclopropyl]thiohydroxylamine
CID 144873991
3-(3-aminopropoxy)-4-methyl-N-[1-(2-methylphenyl)cyclopropyl]benzamide
CID 118772337
2-[2-(2-methoxybutanoylamino)phenyl]acetic acid
CID 119353171
methyl (2R)-2-(1-hydroxycyclopentyl)oxy-4-(2-methylphenyl)butanoate
CID 144861759
2-methoxy-N-methyl-3-(2-methylphenyl)propanamide
CID 141325108
1-(2-phenoxybutanoylamino)cyclobutane-1-carboxylic acid
CID 81164696
methyl 2-[[1-(2-aminophenyl)cyclopropyl]carbamoylamino]acetate
CID 110491051
2-chloro-N-[1-(2-methoxyphenyl)cyclopropyl]acetamide
CID 166408887
2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride
CID 119315817

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide?
The IUPAC name of 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide (CID 131913167) is 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide.
What is the SMILES notation for 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide?
The canonical SMILES for 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide is CCC(OC)C(=O)NC1(c2ccccc2C)CC1.
What is the InChIKey of 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide?
The InChIKey is RAWYBSVTHIDIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-4-13(18-3)14(17)16-15(9-10-15)12-8-6-5-7-11(12)2/h5-8,13H,4,9-10H2,1-3H3,(H,16,17).
What are the key properties of 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide?
2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide has a molecular weight of 247.34 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(2-methylphenyl)cyclopropyl]butanamide is sourced from PubChem (CID 131913167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).