[2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol

C13H25NO — CID 103562043

IUPAC[2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol
SMILESCC1CC(NCC2CCCCC2CO)C1
InChIInChI=1S/C13H25NO/c1-10-6-13(7-10)14-8-11-4-2-3-5-12(11)9-15/h10-15H,2-9H2,1H3
InChIKeyDIKDWNPTWCNNOI-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.17
Rot. Bonds4

About [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol

[2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol (PubChem CID 103562043) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol
PubChem CID103562043
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name[2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol
SMILESCC1CC(NCC2CCCCC2CO)C1
InChIInChI=1S/C13H25NO/c1-10-6-13(7-10)14-8-11-4-2-3-5-12(11)9-15/h10-15H,2-9H2,1H3
InChIKeyDIKDWNPTWCNNOI-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-Methylpiperidin-2-yl)propan-1-ol;hydrochloride
CID 90668992
5-[(3,4-Dimethylcyclohexyl)amino]-4-methylpentan-2-OL
CID 86794772
4-(2-(Methylamino)propyl)cyclohexanol
CID 115669
2-Cyclohexyl-2-(methylamino)ethanol
CID 278542
3-(5-Ethylpiperidin-2-yl)propan-1-ol
CID 335684
[2-[(2,2,2-Trifluoroethylamino)methyl]cyclohexyl]methanol
CID 65904362
[2-[(3,3,3-Trifluoropropylamino)methyl]cyclohexyl]methanol
CID 65904774
[2-[(2,2-Difluoroethylamino)methyl]cyclohexyl]methanol
CID 65904995
3-(3-Methylpiperidin-2-yl)propan-1-ol
CID 78065811
[2-[(2-Fluoroethylamino)methyl]cyclohexyl]methanol
CID 80693888
[2-[(3-Fluoropropylamino)methyl]cyclohexyl]methanol
CID 81107201
[2-[(1,1-Difluoropropan-2-ylamino)methyl]cyclohexyl]methanol
CID 102869691

Frequently Asked Questions

What is the IUPAC name of [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol?
The IUPAC name of [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol (CID 103562043) is [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol is CC1CC(NCC2CCCCC2CO)C1.
What is the InChIKey of [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol?
The InChIKey is DIKDWNPTWCNNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-10-6-13(7-10)14-8-11-4-2-3-5-12(11)9-15/h10-15H,2-9H2,1H3.
What are the key properties of [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol?
[2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol has a molecular weight of 211.35 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(3-methylcyclobutyl)amino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 103562043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).