2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine

C15H27N3 — CID 82692586

IUPAC2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine
SMILESCCc1cc(CC)n(C2CC(CC)CCC2N)n1
InChIInChI=1S/C15H27N3/c1-4-11-7-8-14(16)15(9-11)18-13(6-3)10-12(5-2)17-18/h10-11,14-15H,4-9,16H2,1-3H3
InChIKeyPULVVOAQHZTMHP-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.09
Rot. Bonds4

About 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine

2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine (PubChem CID 82692586) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine
PubChem CID82692586
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine
SMILESCCc1cc(CC)n(C2CC(CC)CCC2N)n1
InChIInChI=1S/C15H27N3/c1-4-11-7-8-14(16)15(9-11)18-13(6-3)10-12(5-2)17-18/h10-11,14-15H,4-9,16H2,1-3H3
InChIKeyPULVVOAQHZTMHP-UHFFFAOYSA-N
XLogP3.09
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-diethylpyrazol-1-yl)cyclopentan-1-amine
CID 82692230
3-(3,5-diethylpyrazol-1-yl)cyclopentan-1-amine
CID 82692472
2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol
CID 82695455
[4-tert-butyl-2-(3,5-diethylpyrazol-1-yl)cyclohexyl]methanamine
CID 82696080
[4-ethyl-2-[(3-ethyl-1-methylpyrazol-5-yl)methyl]cyclohexyl]methanamine
CID 81012010
N-[[2-(3,5-diethylpyrazol-1-yl)cyclobutyl]methyl]cyclopropanamine
CID 82693803
3-(3,5-diethylpyrazol-1-yl)-4-methylpiperidine
CID 82695446
4-ethyl-2-indazol-1-ylcyclohexan-1-amine
CID 62139994
2-(5,6-dimethylbenzimidazol-1-yl)-4-ethylcyclohexan-1-amine
CID 43094518
3-(3,5-diethylpyrazol-1-yl)-N-methyloxan-4-amine
CID 82693590
2-(3,5-diethylpyrazol-1-yl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 82695753
3-(3,5-diethylpyrazol-1-yl)-N-ethylcyclohexan-1-amine
CID 82692471

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine?
The IUPAC name of 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine (CID 82692586) is 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine.
What is the SMILES notation for 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine?
The canonical SMILES for 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine is CCc1cc(CC)n(C2CC(CC)CCC2N)n1.
What is the InChIKey of 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine?
The InChIKey is PULVVOAQHZTMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-11-7-8-14(16)15(9-11)18-13(6-3)10-12(5-2)17-18/h10-11,14-15H,4-9,16H2,1-3H3.
What are the key properties of 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine?
2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine has a molecular weight of 249.40 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine is sourced from PubChem (CID 82692586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).