3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol

C15H25N3O — CID 66004626

IUPAC3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol
SMILESOC1CC(CNCc2ccn(C3CCCCC3)n2)C1
InChIInChI=1S/C15H25N3O/c19-15-8-12(9-15)10-16-11-13-6-7-18(17-13)14-4-2-1-3-5-14/h6-7,12,14-16,19H,1-5,8-11H2
InChIKeyISDCJZSTPHEUDO-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.25
Rot. Bonds5

About 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol

3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol (PubChem CID 66004626) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol
PubChem CID66004626
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol
SMILESOC1CC(CNCc2ccn(C3CCCCC3)n2)C1
InChIInChI=1S/C15H25N3O/c19-15-8-12(9-15)10-16-11-13-6-7-18(17-13)14-4-2-1-3-5-14/h6-7,12,14-16,19H,1-5,8-11H2
InChIKeyISDCJZSTPHEUDO-UHFFFAOYSA-N
XLogP2.25
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol with MolForge

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Related Compounds

N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107418007
1-(2-bicyclo[2.2.1]heptanyl)-N-[(1-cyclopentylpyrazol-3-yl)methyl]methanamine
CID 64799167
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(1,4-dimethylpiperazin-2-yl)methanamine
CID 64799178
N-[[1-[(1-cyclopentylpyrazol-3-yl)methyl]pyrazol-3-yl]methyl]ethanamine
CID 64776990
N-[(1-cyclohexylpyrazol-3-yl)methyl]-2,2-dimethylbutan-1-amine
CID 103461395
N-[(1-cyclohexylpyrazol-3-yl)methyl]hexan-1-amine
CID 64799565
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(1,4-dioxan-2-yl)methanamine
CID 64799891
2-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]-2-ethylbutan-1-ol
CID 106256545
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(4-methylphenyl)methanamine
CID 64801405
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(4-ethylphenyl)methanamine
CID 103816376
4-chloro-N-[(1-cyclohexylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 65023954
1-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105416497

Frequently Asked Questions

What is the IUPAC name of 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol?
The IUPAC name of 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol (CID 66004626) is 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol.
What is the SMILES notation for 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol?
The canonical SMILES for 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol is OC1CC(CNCc2ccn(C3CCCCC3)n2)C1.
What is the InChIKey of 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol?
The InChIKey is ISDCJZSTPHEUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c19-15-8-12(9-15)10-16-11-13-6-7-18(17-13)14-4-2-1-3-5-14/h6-7,12,14-16,19H,1-5,8-11H2.
What are the key properties of 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol?
3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]cyclobutan-1-ol is sourced from PubChem (CID 66004626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).