N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide

C18H22N4O3 — CID 78803224

IUPACN'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide
SMILESCOc1ccc(-c2cc(C(=O)NNC(=O)CC3CCCC3)[nH]n2)cc1
InChIInChI=1S/C18H22N4O3/c1-25-14-8-6-13(7-9-14)15-11-16(20-19-15)18(24)22-21-17(23)10-12-4-2-3-5-12/h6-9,11-12H,2-5,10H2,1H3,(H,19,20)(H,21,23)(H,22,24)
InChIKeyIGQGLWFVHCSJJH-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.43
Rot. Bonds5

About N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide

N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide (PubChem CID 78803224) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide.

Molecular Properties

Compound NameN'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide
PubChem CID78803224
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC NameN'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide
SMILESCOc1ccc(-c2cc(C(=O)NNC(=O)CC3CCCC3)[nH]n2)cc1
InChIInChI=1S/C18H22N4O3/c1-25-14-8-6-13(7-9-14)15-11-16(20-19-15)18(24)22-21-17(23)10-12-4-2-3-5-12/h6-9,11-12H,2-5,10H2,1H3,(H,19,20)(H,21,23)(H,22,24)
InChIKeyIGQGLWFVHCSJJH-UHFFFAOYSA-N
XLogP2.43
TPSA96.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-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

[4-(cyclopentylmethyl)piperazin-1-yl]-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]methanone
CID 70780803
3-(4-methoxyphenyl)-N'-[3-(trifluoromethyl)cyclohexanecarbonyl]-1H-pyrazole-5-carbohydrazide
CID 78887401
N'-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]-3-(4-methylphenyl)-1,2-oxazole-5-carbohydrazide
CID 78870510
N'-[2-(3-fluorophenyl)acetyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide
CID 78803289
N'-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]-5-methyl-1H-pyrazole-3-carbohydrazide
CID 78901393
3-(4-methoxyphenyl)-N'-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)-1H-pyrazole-5-carbohydrazide
CID 78847713
N-(3-hydroxypropyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 71569743
N'-[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]-2,5-dimethylpyrazole-3-carbohydrazide
CID 78904333
N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide
CID 78832186
3-(4-bromophenyl)-N'-[2-(1,1-dioxothiolan-3-yl)acetyl]-1H-pyrazole-5-carbohydrazide
CID 55463127
N-[3-[(2S)-2-(hydroxymethyl)piperidin-1-yl]propyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 97126657
N'-(3-indol-1-ylpropanoyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide
CID 78816707

Frequently Asked Questions

What is the IUPAC name of N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide?
The IUPAC name of N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide (CID 78803224) is N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide.
What is the SMILES notation for N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide?
The canonical SMILES for N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide is COc1ccc(-c2cc(C(=O)NNC(=O)CC3CCCC3)[nH]n2)cc1.
What is the InChIKey of N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide?
The InChIKey is IGQGLWFVHCSJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O3/c1-25-14-8-6-13(7-9-14)15-11-16(20-19-15)18(24)22-21-17(23)10-12-4-2-3-5-12/h6-9,11-12H,2-5,10H2,1H3,(H,19,20)(H,21,23)(H,22,24).
What are the key properties of N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide?
N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide has a molecular weight of 342.40 g/mol, XLogP of 2.43, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-cyclopentylacetyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carbohydrazide is sourced from PubChem (CID 78803224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).