1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid

C13H24N2O2 — CID 79650265

IUPAC1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid
SMILESCN(C1CCCCC1)C1CCC(N)(C(=O)O)C1
InChIInChI=1S/C13H24N2O2/c1-15(10-5-3-2-4-6-10)11-7-8-13(14,9-11)12(16)17/h10-11H,2-9,14H2,1H3,(H,16,17)
InChIKeyFARZBLFJUVCHSP-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.59
Rot. Bonds3

About 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid

1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 79650265) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid
PubChem CID79650265
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid
SMILESCN(C1CCCCC1)C1CCC(N)(C(=O)O)C1
InChIInChI=1S/C13H24N2O2/c1-15(10-5-3-2-4-6-10)11-7-8-13(14,9-11)12(16)17/h10-11H,2-9,14H2,1H3,(H,16,17)
InChIKeyFARZBLFJUVCHSP-UHFFFAOYSA-N
XLogP1.59
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 1-amino-3-[cyclopentyl(methyl)amino]cyclopentane-1-carboxylate
CID 79654658
1-amino-3-(dimethylamino)cyclohexane-1-carboxylic acid
CID 79636513
[1-amino-3-[cyclopentyl(methyl)amino]cyclopentyl]methanol
CID 79656037
1-amino-3-[methyl(3-methylbutan-2-yl)amino]cyclopentane-1-carboxylic acid
CID 79655552
3-[cycloheptyl(methyl)amino]-1-(cyclopropylamino)cyclopentane-1-carboxylic acid
CID 79645904
1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid
CID 79650269
3-[cyclohexyl(methyl)amino]-1-(ethylamino)cyclopentane-1-carboxylic acid
CID 79650504
1-amino-3-[bis(3-methylbutyl)amino]cyclohexane-1-carboxylic acid
CID 107871020
1-amino-3-[cyclopropyl(ethyl)amino]cyclohexane-1-carboxylic acid
CID 79636761
3-[cyclopentyl(methyl)amino]-1-(propylamino)cyclopentane-1-carboxylic acid
CID 79655611
N-cyclobutyl-N-methylcyclohexanamine
CID 90984290
1-amino-3-[cyclopropyl(propyl)amino]cyclohexane-1-carboxylic acid
CID 79636531

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid (CID 79650265) is 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid is CN(C1CCCCC1)C1CCC(N)(C(=O)O)C1.
What is the InChIKey of 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is FARZBLFJUVCHSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-15(10-5-3-2-4-6-10)11-7-8-13(14,9-11)12(16)17/h10-11H,2-9,14H2,1H3,(H,16,17).
What are the key properties of 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid?
1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 240.35 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-[cyclohexyl(methyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 79650265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).