2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid

C8H12N2O4 — CID 167721509

IUPAC2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid
SMILESCC(=O)NC1(C(=O)NCC(=O)O)CC1
InChIInChI=1S/C8H12N2O4/c1-5(11)10-8(2-3-8)7(14)9-4-6(12)13/h2-4H2,1H3,(H,9,14)(H,10,11)(H,12,13)
InChIKeyDGPCISNPUJDQOA-UHFFFAOYSA-N
MW200.19 g/mol
LogP-1.14
Rot. Bonds4

About 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid

2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid (PubChem CID 167721509) has the molecular formula C8H12N2O4 and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid
PubChem CID167721509
Molecular FormulaC8H12N2O4
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid
SMILESCC(=O)NC1(C(=O)NCC(=O)O)CC1
InChIInChI=1S/C8H12N2O4/c1-5(11)10-8(2-3-8)7(14)9-4-6(12)13/h2-4H2,1H3,(H,9,14)(H,10,11)(H,12,13)
InChIKeyDGPCISNPUJDQOA-UHFFFAOYSA-N
XLogP-1.14
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(1-acetamidocyclopropanecarbonyl)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

1-acetamido-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 47345134
acetamide;2-acetamidoacetic acid;acetic acid
CID 172851562
2-[[1-[(1R)-1-hydroxyethyl]cyclopropanecarbonyl]amino]acetic acid
CID 145435288
bis(2-acetamidoacetic acid);copper;trihydrate
CID 57404078
2-[[2-[(1-aminocyclopropanecarbonyl)amino]acetyl]amino]acetic acid
CID 65466641
8-acetamidospiro[4.5]decane-8-carboxylic acid
CID 114818426
N-[1-(2-methylpropanoyl)cyclopropyl]acetamide
CID 176582512
2-[(3-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 63143746
2-acetamidoacetic acid;dihydroxy(oxo)phosphanium
CID 87990829
N-(1-acetylcyclobutyl)acetamide
CID 59658507
2-[(1-methyl-4-propan-2-ylcyclohexanecarbonyl)amino]acetic acid
CID 68999062
2-[[1-(aminomethyl)cyclohexanecarbonyl]amino]acetic acid
CID 115437637

Frequently Asked Questions

What is the IUPAC name of 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid?
The IUPAC name of 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid (CID 167721509) is 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid.
What is the SMILES notation for 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid?
The canonical SMILES for 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid is CC(=O)NC1(C(=O)NCC(=O)O)CC1.
What is the InChIKey of 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid?
The InChIKey is DGPCISNPUJDQOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O4/c1-5(11)10-8(2-3-8)7(14)9-4-6(12)13/h2-4H2,1H3,(H,9,14)(H,10,11)(H,12,13).
What are the key properties of 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid?
2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid has a molecular weight of 200.19 g/mol, XLogP of -1.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-acetamidocyclopropanecarbonyl)amino]acetic acid is sourced from PubChem (CID 167721509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).