1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine

C15H27N3O — CID 64785357

IUPAC1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine
SMILESCCC(C)(N)COCc1ccn(C2CCCCC2)n1
InChIInChI=1S/C15H27N3O/c1-3-15(2,16)12-19-11-13-9-10-18(17-13)14-7-5-4-6-8-14/h9-10,14H,3-8,11-12,16H2,1-2H3
InChIKeyOJMRZZIBSJCYAA-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.03
Rot. Bonds6

About 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine

1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine (PubChem CID 64785357) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine.

Molecular Properties

Compound Name1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine
PubChem CID64785357
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine
SMILESCCC(C)(N)COCc1ccn(C2CCCCC2)n1
InChIInChI=1S/C15H27N3O/c1-3-15(2,16)12-19-11-13-9-10-18(17-13)14-7-5-4-6-8-14/h9-10,14H,3-8,11-12,16H2,1-2H3
InChIKeyOJMRZZIBSJCYAA-UHFFFAOYSA-N
XLogP3.03
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(1-cyclohexylpyrazol-3-yl)methoxymethyl]pentan-3-amine
CID 64784969
1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylpropan-2-amine
CID 64784196
1-[(1-cyclopentylpyrazol-3-yl)methoxy]-2-methylpropan-2-amine
CID 64784388
1-cyclohexyl-3-ethylpyrazole
CID 66014335
1-cyclopentyl-3-(3,3,3-trifluoropropoxymethyl)pyrazole
CID 122171879
2-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-1-amine
CID 64779672
2-[(1-cyclohexylpyrazol-3-yl)methyl]-2-methylbutanenitrile
CID 65377026
3-amino-1-(1-cyclohexylpyrazol-3-yl)-3-ethylpentan-2-one
CID 116592808
1-(1-cyclopentylpyrazol-3-yl)-2-(4-methylphenyl)propan-2-amine
CID 64784289
N-[2-[(1-cyclopentylpyrazol-3-yl)methoxy]ethyl]propan-2-amine
CID 64785550
3-[(1-cyclohexylpyrazol-3-yl)methoxy]-N-propan-2-ylpropan-1-amine
CID 64785741
N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine
CID 64801383

Frequently Asked Questions

What is the IUPAC name of 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine?
The IUPAC name of 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine (CID 64785357) is 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine.
What is the SMILES notation for 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine?
The canonical SMILES for 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine is CCC(C)(N)COCc1ccn(C2CCCCC2)n1.
What is the InChIKey of 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine?
The InChIKey is OJMRZZIBSJCYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-3-15(2,16)12-19-11-13-9-10-18(17-13)14-7-5-4-6-8-14/h9-10,14H,3-8,11-12,16H2,1-2H3.
What are the key properties of 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine?
1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine has a molecular weight of 265.40 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-cyclohexylpyrazol-3-yl)methoxy]-2-methylbutan-2-amine is sourced from PubChem (CID 64785357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).