2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol

C12H23NO — CID 18714363

IUPAC2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)C1CCC(C)(N(C)C)C(O)C1
InChIInChI=1S/C12H23NO/c1-9(2)10-6-7-12(3,13(4)5)11(14)8-10/h10-11,14H,1,6-8H2,2-5H3
InChIKeyRKYDJQCNDXRHMN-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.04
Rot. Bonds2

About 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol

2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol (PubChem CID 18714363) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol
PubChem CID18714363
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)C1CCC(C)(N(C)C)C(O)C1
InChIInChI=1S/C12H23NO/c1-9(2)10-6-7-12(3,13(4)5)11(14)8-10/h10-11,14H,1,6-8H2,2-5H3
InChIKeyRKYDJQCNDXRHMN-UHFFFAOYSA-N
XLogP2.04
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol?
The IUPAC name of 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol (CID 18714363) is 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol is C=C(C)C1CCC(C)(N(C)C)C(O)C1.
What is the InChIKey of 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol?
The InChIKey is RKYDJQCNDXRHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(2)10-6-7-12(3,13(4)5)11(14)8-10/h10-11,14H,1,6-8H2,2-5H3.
What are the key properties of 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol?
2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol is sourced from PubChem (CID 18714363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).