2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol

C12H25NO — CID 13463578

IUPAC2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol
SMILESCN(C)CC(C)(CO)C1CCCCC1
InChIInChI=1S/C12H25NO/c1-12(10-14,9-13(2)3)11-7-5-4-6-8-11/h11,14H,4-10H2,1-3H3
InChIKeyKATTXVKYFZANQT-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.13
Rot. Bonds4

About 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol

2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol (PubChem CID 13463578) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol
PubChem CID13463578
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol
SMILESCN(C)CC(C)(CO)C1CCCCC1
InChIInChI=1S/C12H25NO/c1-12(10-14,9-13(2)3)11-7-5-4-6-8-11/h11,14H,4-10H2,1-3H3
InChIKeyKATTXVKYFZANQT-UHFFFAOYSA-N
XLogP2.13
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol?
The IUPAC name of 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol (CID 13463578) is 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol.
What is the SMILES notation for 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol?
The canonical SMILES for 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol is CN(C)CC(C)(CO)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol?
The InChIKey is KATTXVKYFZANQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-12(10-14,9-13(2)3)11-7-5-4-6-8-11/h11,14H,4-10H2,1-3H3.
What are the key properties of 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol?
2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol has a molecular weight of 199.34 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-3-(dimethylamino)-2-methylpropan-1-ol is sourced from PubChem (CID 13463578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).