4-[cyclobutyl(methyl)amino]cyclohexan-1-ol

C11H21NO — CID 114762700

IUPAC4-[cyclobutyl(methyl)amino]cyclohexan-1-ol
SMILESCN(C1CCC1)C1CCC(O)CC1
InChIInChI=1S/C11H21NO/c1-12(9-3-2-4-9)10-5-7-11(13)8-6-10/h9-11,13H,2-8H2,1H3
InChIKeyMRLBVKKNYFUUEQ-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.77
Rot. Bonds2

About 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol

4-[cyclobutyl(methyl)amino]cyclohexan-1-ol (PubChem CID 114762700) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[cyclobutyl(methyl)amino]cyclohexan-1-ol
PubChem CID114762700
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC Name4-[cyclobutyl(methyl)amino]cyclohexan-1-ol
SMILESCN(C1CCC1)C1CCC(O)CC1
InChIInChI=1S/C11H21NO/c1-12(9-3-2-4-9)10-5-7-11(13)8-6-10/h9-11,13H,2-8H2,1H3
InChIKeyMRLBVKKNYFUUEQ-UHFFFAOYSA-N
XLogP1.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-methylcyclooctanamine
CID 67119180
4-[methyl-(2-methylcyclohexyl)amino]cyclohexan-1-ol
CID 114762511
N-cyclopropyl-N-methylcyclohexanamine;hydrochloride
CID 67002847
N-cyclobutyl-N-methylcyclohexanamine
CID 90984290
4-(dimethylamino)cyclohexan-1-ol;vanadium
CID 176696741
4-[iodo(methyl)amino]cyclohexan-1-ol
CID 143163205
cyclobutanol;cyclopropanol
CID 175019048
3-[cyclopentyl(methyl)amino]-4-methylcyclohexan-1-ol
CID 165497269
N-cyclobutyl-N-(4-hydroxycyclohexyl)formamide
CID 143594834
4-N-cyclooctyl-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122769
trans-(1R,2R)-2-[cyclopropyl(methyl)amino]cyclohexan-1-ol
CID 102731882
cyclohexane-1,4-diol
CID 11162

Frequently Asked Questions

What is the IUPAC name of 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol (CID 114762700) is 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol is CN(C1CCC1)C1CCC(O)CC1.
What is the InChIKey of 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol?
The InChIKey is MRLBVKKNYFUUEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-12(9-3-2-4-9)10-5-7-11(13)8-6-10/h9-11,13H,2-8H2,1H3.
What are the key properties of 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol?
4-[cyclobutyl(methyl)amino]cyclohexan-1-ol has a molecular weight of 183.30 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclobutyl(methyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 114762700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).