2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid

C12H22N2O3 — CID 55147833

IUPAC2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)C(=O)NC1CC1(C)C
InChIInChI=1S/C12H22N2O3/c1-8(2)6-14(7-10(15)16)11(17)13-9-5-12(9,3)4/h8-9H,5-7H2,1-4H3,(H,13,17)(H,15,16)
InChIKeyZQAZJAPMDYIBAG-UHFFFAOYSA-N
MW242.32 g/mol
LogP1.54
Rot. Bonds5

About 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid

2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid (PubChem CID 55147833) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid
PubChem CID55147833
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)C(=O)NC1CC1(C)C
InChIInChI=1S/C12H22N2O3/c1-8(2)6-14(7-10(15)16)11(17)13-9-5-12(9,3)4/h8-9H,5-7H2,1-4H3,(H,13,17)(H,15,16)
InChIKeyZQAZJAPMDYIBAG-UHFFFAOYSA-N
XLogP1.54
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]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

5-[(2,2-dimethylcyclopropyl)amino]-3-methyl-5-oxopentanoic acid
CID 62964927
2-[2-(3-methylbutoxy)ethylcarbamoyl-(2-methylpropyl)amino]acetic acid
CID 63066342
2-[2-ethylbutylcarbamoyl(2-methylpropyl)amino]acetic acid
CID 113363878
2-[cyclopropylmethyl-[(2,2-dimethylcyclohexyl)carbamoyl]amino]acetic acid
CID 79878621
2-[3-methylbutanoyl(2-methylpropyl)amino]acetic acid
CID 62033717
2-[(2-amino-1-methylcyclopentanecarbonyl)-(2-methylpropyl)amino]acetic acid
CID 82768526
2-[2,2-dimethylbutylcarbamoyl(2-methylpropyl)amino]acetic acid
CID 103463265
2-[(4-hydroxy-4-methylpiperidine-1-carbonyl)-(2-methylpropyl)amino]acetic acid
CID 81115479
2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid
CID 102744971
2-[cyclohex-3-en-1-ylmethylcarbamoyl(2-methylpropyl)amino]acetic acid
CID 63064057
2-[[2-(cyclopentylamino)acetyl]-(2-methylpropyl)amino]acetic acid
CID 55148404
2-[(2,6-dimethylphenyl)carbamoyl-(2-methylpropyl)amino]acetic acid
CID 63066316

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid?
The IUPAC name of 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid (CID 55147833) is 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid.
What is the SMILES notation for 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid?
The canonical SMILES for 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid is CC(C)CN(CC(=O)O)C(=O)NC1CC1(C)C.
What is the InChIKey of 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid?
The InChIKey is ZQAZJAPMDYIBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-8(2)6-14(7-10(15)16)11(17)13-9-5-12(9,3)4/h8-9H,5-7H2,1-4H3,(H,13,17)(H,15,16).
What are the key properties of 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid?
2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid has a molecular weight of 242.32 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylcyclopropyl)carbamoyl-(2-methylpropyl)amino]acetic acid is sourced from PubChem (CID 55147833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).