(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine

C15H27N3 — CID 105151143

IUPAC(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine
SMILESCCc1cc(C(N)C2CCCCC2CC)n(C)n1
InChIInChI=1S/C15H27N3/c1-4-11-8-6-7-9-13(11)15(16)14-10-12(5-2)17-18(14)3/h10-11,13,15H,4-9,16H2,1-3H3
InChIKeyKLRGXYXYQKPPSB-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.20
Rot. Bonds4

About (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine

(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine (PubChem CID 105151143) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine.

Molecular Properties

Compound Name(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine
PubChem CID105151143
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine
SMILESCCc1cc(C(N)C2CCCCC2CC)n(C)n1
InChIInChI=1S/C15H27N3/c1-4-11-8-6-7-9-13(11)15(16)14-10-12(5-2)17-18(14)3/h10-11,13,15H,4-9,16H2,1-3H3
InChIKeyKLRGXYXYQKPPSB-UHFFFAOYSA-N
XLogP3.20
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 ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105309605
(2-ethylcyclohexyl)-(3-methylimidazol-4-yl)methanamine
CID 82896494
1-(3-ethyl-1-methylpyrazol-5-yl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 105106898
1-(3-ethyl-1-methylpyrazol-5-yl)-3-methylbutan-1-amine
CID 105083062
cyclopropyl-(1,3-diethylpyrazol-5-yl)methanamine
CID 105157155
[2-[(3-ethyl-1-methylpyrazol-5-yl)methyl]cyclopentyl]methanamine
CID 81009696
(2-ethylcyclohexyl)-(3,4,5-trifluorophenyl)methanamine
CID 63861115
1-(3-ethyl-1-methylpyrazol-5-yl)-5-methylhexan-1-amine
CID 105177018
1-(3-ethyl-1-methylpyrazol-5-yl)undecan-1-amine
CID 105138150
(2-ethylcyclohexyl)-(5-methyl-3-pyridinyl)methanamine
CID 105151254
N-(2-aminocyclohexyl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66121735
(4-bromophenyl)-(2-ethylcyclohexyl)methanamine
CID 55251169

Frequently Asked Questions

What is the IUPAC name of (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
The IUPAC name of (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine (CID 105151143) is (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine.
What is the SMILES notation for (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
The canonical SMILES for (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine is CCc1cc(C(N)C2CCCCC2CC)n(C)n1.
What is the InChIKey of (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
The InChIKey is KLRGXYXYQKPPSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-11-8-6-7-9-13(11)15(16)14-10-12(5-2)17-18(14)3/h10-11,13,15H,4-9,16H2,1-3H3.
What are the key properties of (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
(2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine has a molecular weight of 249.40 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylcyclohexyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine is sourced from PubChem (CID 105151143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).