2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid

C14H24N2O3 — CID 79846087

IUPAC2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid
SMILESCN(C(=O)NC1(CC(=O)O)CCC1)C1CCCCC1
InChIInChI=1S/C14H24N2O3/c1-16(11-6-3-2-4-7-11)13(19)15-14(8-5-9-14)10-12(17)18/h11H,2-10H2,1H3,(H,15,19)(H,17,18)
InChIKeyCNHKXHSZQXMBDY-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.36
Rot. Bonds4

About 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid

2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid (PubChem CID 79846087) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid
PubChem CID79846087
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid
SMILESCN(C(=O)NC1(CC(=O)O)CCC1)C1CCCCC1
InChIInChI=1S/C14H24N2O3/c1-16(11-6-3-2-4-7-11)13(19)15-14(8-5-9-14)10-12(17)18/h11H,2-10H2,1H3,(H,15,19)(H,17,18)
InChIKeyCNHKXHSZQXMBDY-UHFFFAOYSA-N
XLogP2.36
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic 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-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64702597
2-[1-[[cyclobutyl(2-hydroxyethyl)carbamoyl]amino]cyclobutyl]acetic acid
CID 102865457
2-[1-[[[2-(dimethylamino)-2-oxoethyl]-methylcarbamoyl]amino]cyclobutyl]acetic acid
CID 79846292
2-[1-[[methyl(oxan-4-ylmethyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64699572
2-[1-[[(4-ethylphenyl)-methylcarbamoyl]amino]cyclobutyl]acetic acid
CID 79842490
2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid
CID 79849092
2-[1-(dipropylcarbamoylamino)cyclobutyl]acetic acid
CID 79845566
2-[1-[[methyl(2,2,2-trifluoroethyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64700073
2-[1-[[methyl-(4-methylphenyl)carbamoyl]amino]cyclobutyl]acetic acid
CID 79851463
2-[1-(cyclooctanecarbonylamino)cyclohexyl]acetic acid
CID 65019610
2-[1-(diethylcarbamoylamino)cyclopentyl]acetic acid
CID 64701206
2-[1-(dipropylcarbamoylamino)cyclohexyl]acetic acid
CID 64702575

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid?
The IUPAC name of 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid (CID 79846087) is 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid.
What is the SMILES notation for 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid?
The canonical SMILES for 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid is CN(C(=O)NC1(CC(=O)O)CCC1)C1CCCCC1.
What is the InChIKey of 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid?
The InChIKey is CNHKXHSZQXMBDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-16(11-6-3-2-4-7-11)13(19)15-14(8-5-9-14)10-12(17)18/h11H,2-10H2,1H3,(H,15,19)(H,17,18).
What are the key properties of 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid?
2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid is sourced from PubChem (CID 79846087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).