3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid

C14H23NO3 — CID 107175654

IUPAC3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCC1(C)CCCC1C(=O)NC1CCC(C(=O)O)C1
InChIInChI=1S/C14H23NO3/c1-14(2)7-3-4-11(14)12(16)15-10-6-5-9(8-10)13(17)18/h9-11H,3-8H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyCGWALGTVYQGAMZ-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.18
Rot. Bonds3

About 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid

3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 107175654) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID107175654
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCC1(C)CCCC1C(=O)NC1CCC(C(=O)O)C1
InChIInChI=1S/C14H23NO3/c1-14(2)7-3-4-11(14)12(16)15-10-6-5-9(8-10)13(17)18/h9-11H,3-8H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyCGWALGTVYQGAMZ-UHFFFAOYSA-N
XLogP2.18
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 ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-N-(3-methylcyclopentyl)cyclopentane-1-carboxamide
CID 105190701
2-[(2,2-dimethylcyclopentanecarbonyl)amino]cycloheptane-1-carboxylic acid
CID 107175736
2,2-dimethyl-N-(5-methylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 107585034
cis-(1R,3S)-3-[(4-amino-2,2,3-trimethylcyclohexanecarbonyl)amino]cyclopentane-1-carboxylic acid
CID 106322683
2-[(2,2-dimethylcyclohexanecarbonyl)amino]cycloheptane-1-carboxylic acid
CID 107175737
cis-(1S,3R)-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 97030816
cis-(1R,3S)-3-[[4-(cyclopentanecarbonylamino)cyclohexanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 120679065
2,2-dimethyl-N-[(3R)-piperidin-3-yl]cyclopentane-1-carboxamide
CID 107181064
N-(2-aminocyclopentyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107180715
3-(cyclopropylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103549764
cis-(1R,3S)-3-acetamidocyclopentane-1-carboxylic acid
CID 106320767
2-[(2,2-dimethylcyclohexanecarbonyl)amino]-1-methylcyclopentane-1-carboxylic acid
CID 107175872

Frequently Asked Questions

What is the IUPAC name of 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid (CID 107175654) is 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid is CC1(C)CCCC1C(=O)NC1CCC(C(=O)O)C1.
What is the InChIKey of 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is CGWALGTVYQGAMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-14(2)7-3-4-11(14)12(16)15-10-6-5-9(8-10)13(17)18/h9-11H,3-8H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid?
3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 253.34 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 107175654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).