3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol

C14H24N2O — CID 79746221

IUPAC3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol
SMILESCCc1ccc(CC(O)C(C)(C)N(C)C)nc1
InChIInChI=1S/C14H24N2O/c1-6-11-7-8-12(15-10-11)9-13(17)14(2,3)16(4)5/h7-8,10,13,17H,6,9H2,1-5H3
InChIKeyGGQOWRYJEBKKSI-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.89
Rot. Bonds5

About 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol

3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol (PubChem CID 79746221) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol.

Molecular Properties

Compound Name3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol
PubChem CID79746221
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol
SMILESCCc1ccc(CC(O)C(C)(C)N(C)C)nc1
InChIInChI=1S/C14H24N2O/c1-6-11-7-8-12(15-10-11)9-13(17)14(2,3)16(4)5/h7-8,10,13,17H,6,9H2,1-5H3
InChIKeyGGQOWRYJEBKKSI-UHFFFAOYSA-N
XLogP1.89
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-(5-ethyl-2-pyridinyl)-3-methoxypentan-2-ol
CID 116752855
1-(5-ethyl-2-pyridinyl)-4,4,4-trifluorobutan-2-ol
CID 79746123
1-(5-ethyl-2-pyridinyl)-4-methylpentane-2,3-diol
CID 103456372
1-(5-ethyl-2-pyridinyl)-3-phenylpropan-2-ol
CID 79740538
1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine
CID 79006788
2-(5-ethyl-2-pyridinyl)-1-pyrimidin-5-ylethanol
CID 102924082
2-(5-ethyl-2-pyridinyl)-1-(4-methylphenyl)ethanol
CID 79740116
2-(5-ethyl-2-pyridinyl)-1-pyridin-4-ylethanol
CID 79739696
1-(5-ethyl-2-pyridinyl)-3-ethylsulfanylpropan-2-ol
CID 79745603
1-(5-bromo-2-pyridinyl)-3-(dimethylamino)-3-methylpentan-2-ol
CID 104800312
3-(5-ethyl-2-pyridinyl)-2-methylpropan-1-amine
CID 81020364
3-N,3-N-diethyl-1-(5-ethyl-2-pyridinyl)-3-methylpentane-2,3-diamine
CID 79747933

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol?
The IUPAC name of 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol (CID 79746221) is 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol.
What is the SMILES notation for 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol?
The canonical SMILES for 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol is CCc1ccc(CC(O)C(C)(C)N(C)C)nc1.
What is the InChIKey of 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol?
The InChIKey is GGQOWRYJEBKKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-6-11-7-8-12(15-10-11)9-13(17)14(2,3)16(4)5/h7-8,10,13,17H,6,9H2,1-5H3.
What are the key properties of 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol?
3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol has a molecular weight of 236.36 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-(5-ethyl-2-pyridinyl)-3-methylbutan-2-ol is sourced from PubChem (CID 79746221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).