2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid

C11H17NO3 — CID 114543550

IUPAC2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid
SMILESCC1CCC(NC(=O)C2CC2C(=O)O)C1
InChIInChI=1S/C11H17NO3/c1-6-2-3-7(4-6)12-10(13)8-5-9(8)11(14)15/h6-9H,2-5H2,1H3,(H,12,13)(H,14,15)
InChIKeyPCXWFWDFABOLBC-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.01
Rot. Bonds3

About 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid

2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid (PubChem CID 114543550) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid
PubChem CID114543550
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid
SMILESCC1CCC(NC(=O)C2CC2C(=O)O)C1
InChIInChI=1S/C11H17NO3/c1-6-2-3-7(4-6)12-10(13)8-5-9(8)11(14)15/h6-9H,2-5H2,1H3,(H,12,13)(H,14,15)
InChIKeyPCXWFWDFABOLBC-UHFFFAOYSA-N
XLogP1.01
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,2R)-2-[(3-methylcyclopentyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 114093102
2-methyl-N-(3-methylcyclopentyl)cyclopropane-1-carboxamide
CID 114549485
2-[(4-hydroxycyclohexyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 104966695
2-[(4-propylcyclohexyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 54962940
2-(cyclooctylcarbamoyl)cyclopropane-1-carboxylic acid
CID 4638930
cis-(1S,3R)-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 97030816
2-[(1-methylpiperidin-4-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60792023
cis-(1S,2R)-2-[(4-methylcyclohexyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 114091666
2-(aminomethyl)-N-(3-methylcyclopentyl)cyclohexane-1-carboxamide
CID 114546167
(1R,2S,4R)-4-methylcyclohexane-1,2-dicarboxylic acid
CID 92643804
(1S,6S)-6-[(4-methylcyclohexyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 51427698
cis-(1R,2S)-2-[[(1S,3R)-3-(trifluoromethyl)cyclohexyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 124833159

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid?
The IUPAC name of 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid (CID 114543550) is 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid is CC1CCC(NC(=O)C2CC2C(=O)O)C1.
What is the InChIKey of 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid?
The InChIKey is PCXWFWDFABOLBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-6-2-3-7(4-6)12-10(13)8-5-9(8)11(14)15/h6-9H,2-5H2,1H3,(H,12,13)(H,14,15).
What are the key properties of 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid?
2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid has a molecular weight of 211.26 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid is sourced from PubChem (CID 114543550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).