2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol

C14H29NO — CID 79846844

IUPAC2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol
SMILESCCC(C)(C)N(C)C1CCCC(C)(C)C1O
InChIInChI=1S/C14H29NO/c1-7-14(4,5)15(6)11-9-8-10-13(2,3)12(11)16/h11-12,16H,7-10H2,1-6H3
InChIKeyHBKWLZDXDLYPAX-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.05
Rot. Bonds3

About 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol

2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol (PubChem CID 79846844) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol
PubChem CID79846844
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol
SMILESCCC(C)(C)N(C)C1CCCC(C)(C)C1O
InChIInChI=1S/C14H29NO/c1-7-14(4,5)15(6)11-9-8-10-13(2,3)12(11)16/h11-12,16H,7-10H2,1-6H3
InChIKeyHBKWLZDXDLYPAX-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol (CID 79846844) is 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol is CCC(C)(C)N(C)C1CCCC(C)(C)C1O.
What is the InChIKey of 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol?
The InChIKey is HBKWLZDXDLYPAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-7-14(4,5)15(6)11-9-8-10-13(2,3)12(11)16/h11-12,16H,7-10H2,1-6H3.
What are the key properties of 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol?
2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol has a molecular weight of 227.39 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[methyl(2-methylbutan-2-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 79846844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).