2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid

C9H13N3O2 — CID 154882036

IUPAC2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid
SMILESCn1nc(NCC(=O)O)cc1C1CC1
InChIInChI=1S/C9H13N3O2/c1-12-7(6-2-3-6)4-8(11-12)10-5-9(13)14/h4,6H,2-3,5H2,1H3,(H,10,11)(H,13,14)
InChIKeyXSPIDPGFUBKXLD-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.79
Rot. Bonds4

About 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid

2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid (PubChem CID 154882036) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid
PubChem CID154882036
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid
SMILESCn1nc(NCC(=O)O)cc1C1CC1
InChIInChI=1S/C9H13N3O2/c1-12-7(6-2-3-6)4-8(11-12)10-5-9(13)14/h4,6H,2-3,5H2,1H3,(H,10,11)(H,13,14)
InChIKeyXSPIDPGFUBKXLD-UHFFFAOYSA-N
XLogP0.79
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)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

N-(5-cyclohexyl-1-methylpyrazol-3-yl)cyclobutanecarboxamide
CID 164792338
5-cyclohexyl-N,1-dimethylpyrazol-3-amine
CID 116827500
2-(5-cyclopropyl-1-methylpyrazol-3-yl)-2-hydroxyacetic acid
CID 155894444
N-(5-cyclopropyl-1-methylpyrazol-3-yl)-5-iodo-1H-pyrazole-4-carboxamide
CID 154843776
5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine
CID 116827598
N'-(5-cyclopropyl-1-methylpyrazol-3-yl)-N-(2-pyrazin-2-ylethyl)oxamide
CID 166212644
2-[(5-cyclopropyl-1-methylpyrazole-3-carbonyl)amino]propanoic acid
CID 119349056
2-[(2-cyclopropylpyrimidin-4-yl)amino]acetic acid
CID 83830305
(2R)-2-[(5-cyclopropyl-1-methylpyrazole-3-carbonyl)amino]-4-methylpentanoic acid
CID 119364489
5-cyclopropyl-1-methylpyrazol-3-amine
CID 25248190
2-[[1-(difluoromethyl)-5-methylpyrazol-3-yl]amino]acetic acid
CID 154882042
2-(5-cyclopentyl-1-methylpyrazol-3-yl)propanoic acid
CID 105479308

Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid?
The IUPAC name of 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid (CID 154882036) is 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid.
What is the SMILES notation for 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid?
The canonical SMILES for 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid is Cn1nc(NCC(=O)O)cc1C1CC1.
What is the InChIKey of 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid?
The InChIKey is XSPIDPGFUBKXLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-12-7(6-2-3-6)4-8(11-12)10-5-9(13)14/h4,6H,2-3,5H2,1H3,(H,10,11)(H,13,14).
What are the key properties of 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid?
2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid has a molecular weight of 195.22 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyclopropyl-1-methylpyrazol-3-yl)amino]acetic acid is sourced from PubChem (CID 154882036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).