2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid

C9H17NO2 — CID 79856584

IUPAC2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid
SMILESCNC1(C(=O)O)CCCC1(C)C
InChIInChI=1S/C9H17NO2/c1-8(2)5-4-6-9(8,10-3)7(11)12/h10H,4-6H2,1-3H3,(H,11,12)
InChIKeyASVJCCLVDLZUMH-UHFFFAOYSA-N
MW171.24 g/mol
LogP1.24
Rot. Bonds2

About 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid

2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid (PubChem CID 79856584) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid
PubChem CID79856584
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid
SMILESCNC1(C(=O)O)CCCC1(C)C
InChIInChI=1S/C9H17NO2/c1-8(2)5-4-6-9(8,10-3)7(11)12/h10H,4-6H2,1-3H3,(H,11,12)
InChIKeyASVJCCLVDLZUMH-UHFFFAOYSA-N
XLogP1.24
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2-dimethyl-1-(prop-2-ynylamino)cyclopentane-1-carboxylic acid
CID 79856485
(1S)-1,2,2-trimethylcyclopentane-1-carboxylic acid
CID 11805005
1-(2-fluoroanilino)-2,2-dimethylcyclopentane-1-carboxylic acid
CID 79857270
1-(3-chloroanilino)-2,2-dimethylcyclopentane-1-carboxylic acid
CID 79856476
2,2-dimethyl-1-(2-methylanilino)cyclohexane-1-carboxylic acid
CID 79848111
1-(3-bromoanilino)-2,2-dimethylcyclohexane-1-carboxylic acid
CID 79847327
1-(cyclopentylamino)-2,2-dimethylcyclopentane-1-carboxamide
CID 79857143
1-(methylcarbamoylamino)cyclobutane-1-carboxylic acid
CID 81162026
1-hydroxy-2,2-dimethylcyclohexane-1-carboxylic acid
CID 79853126
methyl 1-(cyclopropylmethylamino)-2,2-dimethylcyclopentane-1-carboxylate
CID 79857506
2-[8-(methylamino)spiro[4.5]decan-8-yl]acetic acid
CID 114820838
1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid
CID 65241928

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid (CID 79856584) is 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid is CNC1(C(=O)O)CCCC1(C)C.
What is the InChIKey of 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid?
The InChIKey is ASVJCCLVDLZUMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-8(2)5-4-6-9(8,10-3)7(11)12/h10H,4-6H2,1-3H3,(H,11,12).
What are the key properties of 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid?
2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid has a molecular weight of 171.24 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(methylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 79856584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).