N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide

C10H14IN3O — CID 903286

IUPACN-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide
SMILESCn1ncc(I)c1C(=O)NC1CCCC1
InChIInChI=1S/C10H14IN3O/c1-14-9(8(11)6-12-14)10(15)13-7-4-2-3-5-7/h6-7H,2-5H2,1H3,(H,13,15)
InChIKeyITCGUSSOFWYBOG-UHFFFAOYSA-N
MW319.15 g/mol
LogP1.70
Rot. Bonds2

About N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide

N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide (PubChem CID 903286) has the molecular formula C10H14IN3O and a molecular weight of 319.15 g/mol. Its IUPAC name is N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide
PubChem CID903286
Molecular FormulaC10H14IN3O
Molecular Weight319.15 g/mol
Exact Mass319.02
IUPAC NameN-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide
SMILESCn1ncc(I)c1C(=O)NC1CCCC1
InChIInChI=1S/C10H14IN3O/c1-14-9(8(11)6-12-14)10(15)13-7-4-2-3-5-7/h6-7H,2-5H2,1H3,(H,13,15)
InChIKeyITCGUSSOFWYBOG-UHFFFAOYSA-N
XLogP1.70
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.15
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide 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-cyclohexyl-4-iodo-1-methylpyrazole-5-carboxamide
CID 713201
4-amino-N-cyclohexyl-1-methylpyrazole-5-carboxamide
CID 65356046
N-cyclohexyl-1-methyl-4-prop-2-enylpyrazole-5-carboxamide
CID 170457714
N-tert-butyl-4-iodo-1-methylpyrazole-5-carboxamide
CID 19577504
4-iodo-1-methyl-N-(oxolan-2-ylmethyl)pyrazole-5-carboxamide
CID 4167409
4-iodo-1-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazole-5-carboxamide
CID 40553880
N-cyclopropyl-1-methyl-4-prop-2-enylpyrazole-5-carboxamide
CID 170457707
N-cyclooctyl-1-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 156577123
N-cycloheptyl-2-methyltriazole-4-carboxamide
CID 110691433
4-amino-1-methyl-N-(3-methylsulfanylcyclohexyl)pyrazole-5-carboxamide
CID 114122196
N-cyclopentyl-3-methylimidazole-4-carboxamide
CID 110848735
N-cyclopentyl-1-methylimidazole-2-carboxamide
CID 78994269

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide?
The IUPAC name of N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide (CID 903286) is N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide is Cn1ncc(I)c1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide?
The InChIKey is ITCGUSSOFWYBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14IN3O/c1-14-9(8(11)6-12-14)10(15)13-7-4-2-3-5-7/h6-7H,2-5H2,1H3,(H,13,15).
What are the key properties of N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide?
N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide has a molecular weight of 319.15 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-iodo-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 903286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).