2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol

C15H31NO — CID 79063478

IUPAC2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol
SMILESCCC1CCC(C(O)C(C)(CC)N(C)C)CC1
InChIInChI=1S/C15H31NO/c1-6-12-8-10-13(11-9-12)14(17)15(3,7-2)16(4)5/h12-14,17H,6-11H2,1-5H3
InChIKeyYPYZGNPSNSPQFH-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.29
Rot. Bonds5

About 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol

2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol (PubChem CID 79063478) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol
PubChem CID79063478
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol
SMILESCCC1CCC(C(O)C(C)(CC)N(C)C)CC1
InChIInChI=1S/C15H31NO/c1-6-12-8-10-13(11-9-12)14(17)15(3,7-2)16(4)5/h12-14,17H,6-11H2,1-5H3
InChIKeyYPYZGNPSNSPQFH-UHFFFAOYSA-N
XLogP3.29
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-(dimethylamino)-2-methylbutan-1-ol
CID 79064519
2-(dimethylamino)-2-methyl-1-(oxan-4-yl)butan-1-ol
CID 79064392
1-(4-ethylcyclohexyl)-2,2-dimethylpropan-1-ol
CID 64748582
1-(4-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylbutan-1-ol
CID 79065767
cyclooctyl-(4-ethylcyclohexyl)methanol
CID 80602985
cyclohexyl-(4-ethylcyclohexyl)methanol
CID 64749927
1-(4-ethylcyclohexyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
CID 79054004
2,2-dicyclopropyl-1-(4-ethylcyclohexyl)ethanol
CID 112743634
2,2-dimethyl-1-(4-propylcyclohexyl)propan-1-ol
CID 65424304
1-(4-ethylcyclohexyl)-4,4-dimethylpentan-1-ol
CID 65394345
[1-(dimethylamino)cycloheptyl]-(4-ethylcyclohexyl)methanol
CID 79075083
1-cyclohexyl-2-(dimethylamino)-2-methylpropan-1-ol
CID 79046048

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol?
The IUPAC name of 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol (CID 79063478) is 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol.
What is the SMILES notation for 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol?
The canonical SMILES for 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol is CCC1CCC(C(O)C(C)(CC)N(C)C)CC1.
What is the InChIKey of 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol?
The InChIKey is YPYZGNPSNSPQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-6-12-8-10-13(11-9-12)14(17)15(3,7-2)16(4)5/h12-14,17H,6-11H2,1-5H3.
What are the key properties of 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol?
2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol has a molecular weight of 241.42 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(4-ethylcyclohexyl)-2-methylbutan-1-ol is sourced from PubChem (CID 79063478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).