1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid

C14H23NO3 — CID 107175126

IUPAC1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
SMILESCC1CCCC1C(=O)NC1(C(=O)O)CCCCC1
InChIInChI=1S/C14H23NO3/c1-10-6-5-7-11(10)12(16)15-14(13(17)18)8-3-2-4-9-14/h10-11H,2-9H2,1H3,(H,15,16)(H,17,18)
InChIKeyCUFYTTKWIYQKQR-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.33
Rot. Bonds3

About 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid

1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid (PubChem CID 107175126) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
PubChem CID107175126
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
SMILESCC1CCCC1C(=O)NC1(C(=O)O)CCCCC1
InChIInChI=1S/C14H23NO3/c1-10-6-5-7-11(10)12(16)15-14(13(17)18)8-3-2-4-9-14/h10-11H,2-9H2,1H3,(H,15,16)(H,17,18)
InChIKeyCUFYTTKWIYQKQR-UHFFFAOYSA-N
XLogP2.33
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid
CID 107175622
1-[(2-methylcyclohexanecarbonyl)amino]cyclopropane-1-carboxylic acid
CID 122129367
1-[(3-methyloxane-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 114240909
1-[(2-methyloxolane-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 79750991
1-(bicyclo[4.1.0]heptane-7-carbonylamino)cyclohexane-1-carboxylic acid
CID 81356177
1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 106703045
1-[[(1S)-2,2-dimethylcyclopropanecarbonyl]amino]cyclohexane-1-carboxylic acid
CID 120666263
1-[(2-aminocyclopentanecarbonyl)amino]-3-methylcyclohexane-1-carboxylic acid
CID 64823648
1-[(1-methylpyrrolidine-3-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 54938838
1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid
CID 106703092
1-(thiane-4-carbonylamino)cycloheptane-1-carboxylic acid
CID 120538857
1-[(1-acetylpiperidine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 120539156

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid?
The IUPAC name of 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid (CID 107175126) is 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid.
What is the SMILES notation for 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid?
The canonical SMILES for 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid is CC1CCCC1C(=O)NC1(C(=O)O)CCCCC1.
What is the InChIKey of 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid?
The InChIKey is CUFYTTKWIYQKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-10-6-5-7-11(10)12(16)15-14(13(17)18)8-3-2-4-9-14/h10-11H,2-9H2,1H3,(H,15,16)(H,17,18).
What are the key properties of 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid?
1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid has a molecular weight of 253.34 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid is sourced from PubChem (CID 107175126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).