1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine

C16H29N3 — CID 104747419

IUPAC1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine
SMILESCCNC(Cn1nc(C)c(C)c1C)C1CCCCC1
InChIInChI=1S/C16H29N3/c1-5-17-16(15-9-7-6-8-10-15)11-19-14(4)12(2)13(3)18-19/h15-17H,5-11H2,1-4H3
InChIKeyHBFXWVUQSIHPLR-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.37
Rot. Bonds5

About 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine

1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine (PubChem CID 104747419) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine
PubChem CID104747419
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine
SMILESCCNC(Cn1nc(C)c(C)c1C)C1CCCCC1
InChIInChI=1S/C16H29N3/c1-5-17-16(15-9-7-6-8-10-15)11-19-14(4)12(2)13(3)18-19/h15-17H,5-11H2,1-4H3
InChIKeyHBFXWVUQSIHPLR-UHFFFAOYSA-N
XLogP3.37
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine 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

1-cyclopentyl-N-methyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine
CID 113448415
2-(4-chloro-5-methylpyrazol-1-yl)-1-cyclohexyl-N-ethylethanamine
CID 104747830
N-ethyl-1-(3,4,5-trimethylpyrazol-1-yl)butan-2-amine
CID 62038265
1-cyclopropyl-2-(4,5-dimethylimidazol-1-yl)-N-ethylethanamine
CID 63913754
1-cyclohexyl-N-ethyl-2-(4-methylpyrazol-1-yl)ethanamine
CID 104747389
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
3-(ethylamino)-4-(3,4,5-trimethylpyrazol-1-yl)butan-1-ol
CID 64897360
1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione
CID 104747634
1-cyclohexyl-N-ethyl-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylethanamine
CID 104755844
1-cycloheptyl-N-ethyl-2-methoxyethanamine
CID 79574660
1-cyclohexyl-2-(4,4-dimethylazepan-1-yl)-N-ethylethanamine
CID 104746542
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 104746160

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine?
The IUPAC name of 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine (CID 104747419) is 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine.
What is the SMILES notation for 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine?
The canonical SMILES for 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine is CCNC(Cn1nc(C)c(C)c1C)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine?
The InChIKey is HBFXWVUQSIHPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-5-17-16(15-9-7-6-8-10-15)11-19-14(4)12(2)13(3)18-19/h15-17H,5-11H2,1-4H3.
What are the key properties of 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine?
1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine has a molecular weight of 263.43 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine is sourced from PubChem (CID 104747419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).