1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol

C17H21NO — CID 159272706

IUPAC1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol
SMILESC=C1C(C(C)O)=CC(C)=C(c2ccccc2)N1CC
InChIInChI=1S/C17H21NO/c1-5-18-13(3)16(14(4)19)11-12(2)17(18)15-9-7-6-8-10-15/h6-11,14,19H,3,5H2,1-2,4H3
InChIKeyKXXJCNSHJFLPSW-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.57
Rot. Bonds3

About 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol

1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol (PubChem CID 159272706) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol
PubChem CID159272706
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol
SMILESC=C1C(C(C)O)=CC(C)=C(c2ccccc2)N1CC
InChIInChI=1S/C17H21NO/c1-5-18-13(3)16(14(4)19)11-12(2)17(18)15-9-7-6-8-10-15/h6-11,14,19H,3,5H2,1-2,4H3
InChIKeyKXXJCNSHJFLPSW-UHFFFAOYSA-N
XLogP3.57
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol?
The IUPAC name of 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol (CID 159272706) is 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol.
What is the SMILES notation for 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol?
The canonical SMILES for 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol is C=C1C(C(C)O)=CC(C)=C(c2ccccc2)N1CC.
What is the InChIKey of 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol?
The InChIKey is KXXJCNSHJFLPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-5-18-13(3)16(14(4)19)11-12(2)17(18)15-9-7-6-8-10-15/h6-11,14,19H,3,5H2,1-2,4H3.
What are the key properties of 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol?
1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol has a molecular weight of 255.36 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-5-methyl-2-methylidene-6-phenyl-3-pyridinyl)ethanol is sourced from PubChem (CID 159272706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).