N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine

C15H23N3 — CID 75496238

IUPACN-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine
SMILESCC(C1CC1)n1nccc1NCC1CC=CCC1
InChIInChI=1S/C15H23N3/c1-12(14-7-8-14)18-15(9-10-17-18)16-11-13-5-3-2-4-6-13/h2-3,9-10,12-14,16H,4-8,11H2,1H3
InChIKeyHSQSAHVYZSLUCH-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.62
Rot. Bonds5

About N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine

N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine (PubChem CID 75496238) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine.

Molecular Properties

Compound NameN-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine
PubChem CID75496238
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC NameN-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine
SMILESCC(C1CC1)n1nccc1NCC1CC=CCC1
InChIInChI=1S/C15H23N3/c1-12(14-7-8-14)18-15(9-10-17-18)16-11-13-5-3-2-4-6-13/h2-3,9-10,12-14,16H,4-8,11H2,1H3
InChIKeyHSQSAHVYZSLUCH-UHFFFAOYSA-N
XLogP3.62
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(cyclohex-3-en-1-ylmethyl)-4-pyrazol-1-ylbutan-2-amine
CID 121515078
1-(3-fluoro-4-propan-2-ylcyclohexa-1,5-dien-1-yl)-N-methylpyrazol-3-amine
CID 135232912
N-[(3E)-5-(2-fluoro-2-methylcyclopropyl)penta-1,3-dien-2-yl]-1-methylpyrazol-3-amine
CID 177342696
N-(1-cyclopropylpropan-2-yl)-1-(2,2-difluoroethyl)pyrazol-3-amine
CID 115921007
N-(1-cyclopropylpropyl)-1-(2,2-difluoroethyl)pyrazol-3-amine
CID 115921011
N-(2-ethylpyrazol-3-yl)cyclohex-3-ene-1-carboxamide
CID 47020062
1-[4-[(4-aminocyclohexyl)methylamino]butyl]-N-methylpyrazol-3-amine
CID 59231271
2-(2-Bicyclo[2.2.1]hept-5-enylmethyl)pyrazol-3-amine
CID 67515873
2-pentyl-N-prop-2-enylpyrazol-3-amine
CID 70354255
5-Cyclohexyl-4-methyl-7-methylidenepyrazolo[1,5-a]pyrimidine
CID 89058500
2-(1-Methyl-5-propan-2-ylcyclohex-3-en-1-yl)pyrazol-3-amine
CID 89482608
2-(1,5-Dimethylcyclohex-3-en-1-yl)pyrazol-3-amine
CID 89482853

Frequently Asked Questions

What is the IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine?
The IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine (CID 75496238) is N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine.
What is the SMILES notation for N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine?
The canonical SMILES for N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine is CC(C1CC1)n1nccc1NCC1CC=CCC1.
What is the InChIKey of N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine?
The InChIKey is HSQSAHVYZSLUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-12(14-7-8-14)18-15(9-10-17-18)16-11-13-5-3-2-4-6-13/h2-3,9-10,12-14,16H,4-8,11H2,1H3.
What are the key properties of N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine?
N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine has a molecular weight of 245.37 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohex-3-en-1-ylmethyl)-2-(1-cyclopropylethyl)pyrazol-3-amine is sourced from PubChem (CID 75496238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).