2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride

C11H25ClN2O — CID 130878660

IUPAC2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride
SMILESCN(CC(C)(C)N)C1CCCCC1O.Cl
InChIInChI=1S/C11H24N2O.ClH/c1-11(2,12)8-13(3)9-6-4-5-7-10(9)14;/h9-10,14H,4-8,12H2,1-3H3;1H
InChIKeyDIOLAFCQSQILTB-UHFFFAOYSA-N
MW236.79 g/mol
LogP1.38
Rot. Bonds3

About 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride

2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride (PubChem CID 130878660) has the molecular formula C11H25ClN2O and a molecular weight of 236.79 g/mol. Its IUPAC name is 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride.

Molecular Properties

Compound Name2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride
PubChem CID130878660
Molecular FormulaC11H25ClN2O
Molecular Weight236.79 g/mol
Exact Mass236.17
IUPAC Name2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride
SMILESCN(CC(C)(C)N)C1CCCCC1O.Cl
InChIInChI=1S/C11H24N2O.ClH/c1-11(2,12)8-13(3)9-6-4-5-7-10(9)14;/h9-10,14H,4-8,12H2,1-3H3;1H
InChIKeyDIOLAFCQSQILTB-UHFFFAOYSA-N
XLogP1.38
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.79
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1R,2R)-2-[(2-hydroxy-2-methylpropyl)-methylamino]cyclohexan-1-ol
CID 104954571
3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide
CID 102632066
2-[[2-(ethylaminomethyl)-2-methylbutyl]-methylamino]cyclohexan-1-ol
CID 102637047
trans-(1S,2S)-1-N,2-N-bis(2,2-dimethylpropyl)-1-N,2-N-dimethylcyclohexane-1,2-diamine
CID 59492154
2-[(2-amino-5-tert-butylcyclohexyl)methyl-methylamino]cyclohexan-1-ol
CID 102637096
2-[cyclopropylmethyl(methyl)amino]cyclopentan-1-ol
CID 60985143
2-amino-N-(2-hydroxycyclohexyl)-N,2-dimethylbutanamide
CID 102632097
2-[3-(dimethylamino)propyl-methylamino]cyclohexan-1-ol
CID 63698872
2-[2,2-difluoroethyl(methyl)amino]cyclohexan-1-ol
CID 115773222
trans-(1S,2S)-2-[methyl-[(2-methylcyclopropyl)methyl]amino]cyclohexan-1-ol
CID 102732161
trans-(1R,2R)-2-[2,2-difluoroethyl(methyl)amino]cyclohexan-1-ol
CID 104954609
N'-hydroxy-2-[(2-hydroxycyclohexyl)-methylamino]ethanimidamide
CID 102632406

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride?
The IUPAC name of 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride (CID 130878660) is 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride.
What is the SMILES notation for 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride?
The canonical SMILES for 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride is CN(CC(C)(C)N)C1CCCCC1O.Cl.
What is the InChIKey of 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride?
The InChIKey is DIOLAFCQSQILTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O.ClH/c1-11(2,12)8-13(3)9-6-4-5-7-10(9)14;/h9-10,14H,4-8,12H2,1-3H3;1H.
What are the key properties of 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride?
2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride has a molecular weight of 236.79 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride is sourced from PubChem (CID 130878660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).