2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol

C15H27N3O — CID 64800330

IUPAC2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol
SMILESCCC(C)(CO)NCc1ccn(C2CCCCC2)n1
InChIInChI=1S/C15H27N3O/c1-3-15(2,12-19)16-11-13-9-10-18(17-13)14-7-5-4-6-8-14/h9-10,14,16,19H,3-8,11-12H2,1-2H3
InChIKeyVYWGWGSYFTYXES-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.64
Rot. Bonds6

About 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol

2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol (PubChem CID 64800330) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol
PubChem CID64800330
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol
SMILESCCC(C)(CO)NCc1ccn(C2CCCCC2)n1
InChIInChI=1S/C15H27N3O/c1-3-15(2,12-19)16-11-13-9-10-18(17-13)14-7-5-4-6-8-14/h9-10,14,16,19H,3-8,11-12H2,1-2H3
InChIKeyVYWGWGSYFTYXES-UHFFFAOYSA-N
XLogP2.64
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol 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

N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine
CID 64801383
2-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]-2-ethylbutan-1-ol
CID 106256545
N-[(1-cyclohexylpyrazol-3-yl)methyl]-2,2-dimethylbutan-1-amine
CID 103461395
2-[(1-cyclopentylpyrazol-3-yl)methylamino]-2-methylpropanamide
CID 64800668
1-cyclohexyl-3-ethylpyrazole
CID 66014335
N-[(1-cyclohexylpyrazol-3-yl)methyl]pentan-3-amine
CID 64799267
1-(1-cyclohexylpyrazol-3-yl)-N-ethoxymethanamine
CID 64975019
2-[(1-cyclohexylpyrazol-3-yl)methyl]-2-methylbutanenitrile
CID 65377026
N-[(1-cyclopentylpyrazol-3-yl)methyl]-4-ethoxyaniline
CID 19626044
N-[(1-cyclopentylpyrazol-3-yl)methyl]butan-2-amine
CID 64801770
N-[(1-cyclohexylpyrazol-3-yl)methyl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79359218
N-[(1-cyclopentylpyrazol-3-yl)methyl]-4-methylaniline
CID 19626027

Frequently Asked Questions

What is the IUPAC name of 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol?
The IUPAC name of 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol (CID 64800330) is 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol.
What is the SMILES notation for 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol?
The canonical SMILES for 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol is CCC(C)(CO)NCc1ccn(C2CCCCC2)n1.
What is the InChIKey of 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol?
The InChIKey is VYWGWGSYFTYXES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-3-15(2,12-19)16-11-13-9-10-18(17-13)14-7-5-4-6-8-14/h9-10,14,16,19H,3-8,11-12H2,1-2H3.
What are the key properties of 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol?
2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol has a molecular weight of 265.40 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol is sourced from PubChem (CID 64800330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).