2-cyclopropyl-1,3-thiazole-4-carbohydrazide

C7H9N3OS — CID 131063820

IUPAC2-cyclopropyl-1,3-thiazole-4-carbohydrazide
SMILESNNC(=O)c1csc(C2CC2)n1
InChIInChI=1S/C7H9N3OS/c8-10-6(11)5-3-12-7(9-5)4-1-2-4/h3-4H,1-2,8H2,(H,10,11)
InChIKeySSJKFQVDKYXQCT-UHFFFAOYSA-N
MW183.24 g/mol
LogP0.62
Rot. Bonds2

About 2-cyclopropyl-1,3-thiazole-4-carbohydrazide

2-cyclopropyl-1,3-thiazole-4-carbohydrazide (PubChem CID 131063820) has the molecular formula C7H9N3OS and a molecular weight of 183.24 g/mol. Its IUPAC name is 2-cyclopropyl-1,3-thiazole-4-carbohydrazide.

Molecular Properties

Compound Name2-cyclopropyl-1,3-thiazole-4-carbohydrazide
PubChem CID131063820
Molecular FormulaC7H9N3OS
Molecular Weight183.24 g/mol
Exact Mass183.05
IUPAC Name2-cyclopropyl-1,3-thiazole-4-carbohydrazide
SMILESNNC(=O)c1csc(C2CC2)n1
InChIInChI=1S/C7H9N3OS/c8-10-6(11)5-3-12-7(9-5)4-1-2-4/h3-4H,1-2,8H2,(H,10,11)
InChIKeySSJKFQVDKYXQCT-UHFFFAOYSA-N
XLogP0.62
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.24
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-cyclopropyl-1,3-thiazole-4-carbohydrazide 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

trans-(1R,2R)-2-[(2-cyclopropyl-1,3-thiazole-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 99645088
2-cyclopentyl-2-[(2-cyclopropyl-1,3-thiazole-4-carbonyl)amino]acetic acid
CID 138036512
2-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 66679882
2-cyclopropyl-N'-[(2S)-oxolane-2-carbonyl]-1,3-thiazole-4-carbohydrazide
CID 166201928
ethyl 2-cyclobutyl-1,3-thiazole-4-carboxylate
CID 54513950
2-cyclopropyl-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-1,3-thiazole-4-carboxamide;dihydrochloride
CID 120891937
ethyl 4-(4-bromo-1,3-thiazol-2-yl)cyclohexane-1-carboxylate
CID 125499503
ethyl 4-[(2-piperidin-4-yl-1,3-thiazole-4-carbonyl)amino]piperidine-1-carboxylate
CID 5091991
2-(trifluoromethyl)-1,3-thiazole-4-carbohydrazide
CID 89488133
2-cyclopropyl-N-(5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-yl)-1,3-thiazole-4-carboxamide;dihydrochloride
CID 120884051
1-[2-(3-ethylcyclopentyl)-1,3-thiazol-4-yl]ethanone
CID 65404993
N-(9H-fluoren-9-yl)-2-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 3553057

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1,3-thiazole-4-carbohydrazide?
The IUPAC name of 2-cyclopropyl-1,3-thiazole-4-carbohydrazide (CID 131063820) is 2-cyclopropyl-1,3-thiazole-4-carbohydrazide.
What is the SMILES notation for 2-cyclopropyl-1,3-thiazole-4-carbohydrazide?
The canonical SMILES for 2-cyclopropyl-1,3-thiazole-4-carbohydrazide is NNC(=O)c1csc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-1,3-thiazole-4-carbohydrazide?
The InChIKey is SSJKFQVDKYXQCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3OS/c8-10-6(11)5-3-12-7(9-5)4-1-2-4/h3-4H,1-2,8H2,(H,10,11).
What are the key properties of 2-cyclopropyl-1,3-thiazole-4-carbohydrazide?
2-cyclopropyl-1,3-thiazole-4-carbohydrazide has a molecular weight of 183.24 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1,3-thiazole-4-carbohydrazide is sourced from PubChem (CID 131063820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).