2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid

C10H15NO3 — CID 115730407

IUPAC2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
SMILESCN(C(=O)C1CC1C(=O)O)C1CCC1
InChIInChI=1S/C10H15NO3/c1-11(6-3-2-4-6)9(12)7-5-8(7)10(13)14/h6-8H,2-5H2,1H3,(H,13,14)
InChIKeyFSNCXXAAVKDNGL-UHFFFAOYSA-N
MW197.23 g/mol
LogP0.72
Rot. Bonds3

About 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid

2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid (PubChem CID 115730407) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
PubChem CID115730407
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
SMILESCN(C(=O)C1CC1C(=O)O)C1CCC1
InChIInChI=1S/C10H15NO3/c1-11(6-3-2-4-6)9(12)7-5-8(7)10(13)14/h6-8H,2-5H2,1H3,(H,13,14)
InChIKeyFSNCXXAAVKDNGL-UHFFFAOYSA-N
XLogP0.72
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,2R)-2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 93311623
2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103977670
2-[methyl(oxolan-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 82732714
2-[methyl(thiolan-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60791236
2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate
CID 18434341
2-(dicyclohexylcarbamoyl)cyclopropane-1-carboxylic acid
CID 60790595
2-[methyl-(4-methylcyclohexyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 43579803
methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate
CID 54557644
cis-(1S,2R)-2-[methoxy(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 93311851
4-ethyl-2-[methyl-(2-methylcyclohexyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 114511568
4-[cycloheptyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63784841
2-[methyl-(1-methylpiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978705

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid?
The IUPAC name of 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid (CID 115730407) is 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid is CN(C(=O)C1CC1C(=O)O)C1CCC1.
What is the InChIKey of 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid?
The InChIKey is FSNCXXAAVKDNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-11(6-3-2-4-6)9(12)7-5-8(7)10(13)14/h6-8H,2-5H2,1H3,(H,13,14).
What are the key properties of 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid?
2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid has a molecular weight of 197.23 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid is sourced from PubChem (CID 115730407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).