2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid

C11H19N3O4 — CID 107438810

IUPAC2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid
SMILESCC(CC1CC1)NC(=O)N(CC(N)=O)CC(=O)O
InChIInChI=1S/C11H19N3O4/c1-7(4-8-2-3-8)13-11(18)14(5-9(12)15)6-10(16)17/h7-8H,2-6H2,1H3,(H2,12,15)(H,13,18)(H,16,17)
InChIKeyBIHDMBUPGQKZFW-UHFFFAOYSA-N
MW257.29 g/mol
LogP-0.24
Rot. Bonds7

About 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid

2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid (PubChem CID 107438810) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid
PubChem CID107438810
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC Name2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid
SMILESCC(CC1CC1)NC(=O)N(CC(N)=O)CC(=O)O
InChIInChI=1S/C11H19N3O4/c1-7(4-8-2-3-8)13-11(18)14(5-9(12)15)6-10(16)17/h7-8H,2-6H2,1H3,(H2,12,15)(H,13,18)(H,16,17)
InChIKeyBIHDMBUPGQKZFW-UHFFFAOYSA-N
XLogP-0.24
TPSA112.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)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

2-[(2-amino-2-oxoethyl)-(1-piperidin-1-ylpropan-2-ylcarbamoyl)amino]acetic acid
CID 107438309
2-[N-(1-cyclopropylpropan-2-ylcarbamoyl)-4-methylanilino]acetic acid
CID 63995347
2-[cyclopropylmethyl-[(1-methoxy-1-oxopropan-2-yl)carbamoyl]amino]acetic acid
CID 54959971
3-(1-cyclopropylpropan-2-ylamino)-3-oxopropanoic acid
CID 63994028
2-[(2-amino-2-oxoethyl)-[[1-(ethylamino)-1-oxopropan-2-yl]carbamoyl]amino]acetic acid
CID 107438288
2-[(2-amino-2-oxoethyl)-[cyclopropylmethyl(methyl)carbamoyl]amino]acetic acid
CID 107438105
2-[(2-amino-2-oxoethyl)-(cyclooctylcarbamoyl)amino]acetic acid
CID 107437429
2-[bis(2-amino-2-oxoethyl)carbamoylamino]-3-hydroxybutanoic acid
CID 62921939
2-[(2-amino-2-oxoethyl)-[2-(carbamoylamino)propanoyl]amino]acetic acid
CID 107434098
2-amino-N-(1-cyclopropylpropan-2-yl)butanediamide;hydrochloride
CID 119957385
2-[(2-amino-2-oxoethyl)-(thian-4-ylmethylcarbamoyl)amino]acetic acid
CID 107439301
2-[(2-amino-2-oxoethyl)-[2-(1-methylpiperidin-4-yl)ethylcarbamoyl]amino]acetic acid
CID 107439389

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid (CID 107438810) is 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid is CC(CC1CC1)NC(=O)N(CC(N)=O)CC(=O)O.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid?
The InChIKey is BIHDMBUPGQKZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4/c1-7(4-8-2-3-8)13-11(18)14(5-9(12)15)6-10(16)17/h7-8H,2-6H2,1H3,(H2,12,15)(H,13,18)(H,16,17).
What are the key properties of 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid?
2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid has a molecular weight of 257.29 g/mol, XLogP of -0.24, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-(1-cyclopropylpropan-2-ylcarbamoyl)amino]acetic acid is sourced from PubChem (CID 107438810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).