1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine

C15H27N3 — CID 105079431

IUPAC1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine
SMILESCCc1cc(C(NC)C2CCCCC2)n(CC)n1
InChIInChI=1S/C15H27N3/c1-4-13-11-14(18(5-2)17-13)15(16-3)12-9-7-6-8-10-12/h11-12,15-16H,4-10H2,1-3H3
InChIKeySLAWBJAYMIWROL-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.31
Rot. Bonds5

About 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine

1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine (PubChem CID 105079431) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine
PubChem CID105079431
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine
SMILESCCc1cc(C(NC)C2CCCCC2)n(CC)n1
InChIInChI=1S/C15H27N3/c1-4-13-11-14(18(5-2)17-13)15(16-3)12-9-7-6-8-10-12/h11-12,15-16H,4-10H2,1-3H3
InChIKeySLAWBJAYMIWROL-UHFFFAOYSA-N
XLogP3.31
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[cyclohexyl-(1,3-diethylpyrazol-5-yl)methyl]hydrazine
CID 105282054
1-cycloheptyl-1-(2-ethyl-5-methylpyrazol-3-yl)-N-methylmethanamine
CID 105176375
N-[cyclohexyl-(1,3-diethylpyrazol-5-yl)methyl]propan-1-amine
CID 105079721
N-[cyclopropyl-(1,3-diethylpyrazol-5-yl)methyl]propan-1-amine
CID 105157194
1-cyclopentyl-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 63976376
1-(3-ethyl-1-methylpyrazol-5-yl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 105155802
N-[2-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)ethyl]propan-1-amine
CID 105135714
N-[(1,3-diethylpyrazol-5-yl)-(3,5-dimethylcyclohexyl)methyl]ethanamine
CID 105154223
cyclopropyl-(1,3-diethylpyrazol-5-yl)methanamine
CID 105157155
1,3-diethyl-5-propan-2-ylpyrazole
CID 118564106
1-cycloheptyl-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 82932122
1-(1,3-diethylpyrazol-5-yl)-N,3-dimethylbutan-1-amine
CID 105082907

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine (CID 105079431) is 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine is CCc1cc(C(NC)C2CCCCC2)n(CC)n1.
What is the InChIKey of 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine?
The InChIKey is SLAWBJAYMIWROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-13-11-14(18(5-2)17-13)15(16-3)12-9-7-6-8-10-12/h11-12,15-16H,4-10H2,1-3H3.
What are the key properties of 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine?
1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine has a molecular weight of 249.40 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 105079431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).