1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol

C18H21NO — CID 63773352

IUPAC1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
SMILESCc1cccnc1C(O)CC1CCCc2ccccc21
InChIInChI=1S/C18H21NO/c1-13-6-5-11-19-18(13)17(20)12-15-9-4-8-14-7-2-3-10-16(14)15/h2-3,5-7,10-11,15,17,20H,4,8-9,12H2,1H3
InChIKeyBQKHCTZFWPCGMS-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.93
Rot. Bonds3

About 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol

1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol (PubChem CID 63773352) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol.

Molecular Properties

Compound Name1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
PubChem CID63773352
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
SMILESCc1cccnc1C(O)CC1CCCc2ccccc21
InChIInChI=1S/C18H21NO/c1-13-6-5-11-19-18(13)17(20)12-15-9-4-8-14-7-2-3-10-16(14)15/h2-3,5-7,10-11,15,17,20H,4,8-9,12H2,1H3
InChIKeyBQKHCTZFWPCGMS-UHFFFAOYSA-N
XLogP3.93
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-pyridin-2-yl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63771109
1-(2-methoxy-3-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 105081457
2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanol
CID 64904867
[1-pyrimidin-2-yl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]hydrazine
CID 105203641
N-[(3-methyl-2-pyridinyl)methyl]-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63771252
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
1-(2-propylpyrazol-3-yl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 114557066
(1R)-1-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 138977422
1,1-diethoxy-3-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-ol
CID 79495849
1-ethylsulfanyl-3-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-ol
CID 65130800
1-(3,5-difluorophenyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63773172
1-[(2,6-dimethylphenoxy)methyl]-1,2,3,4-tetrahydronaphthalene
CID 83056818

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol?
The IUPAC name of 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol (CID 63773352) is 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol.
What is the SMILES notation for 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol?
The canonical SMILES for 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol is Cc1cccnc1C(O)CC1CCCc2ccccc21.
What is the InChIKey of 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol?
The InChIKey is BQKHCTZFWPCGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-13-6-5-11-19-18(13)17(20)12-15-9-4-8-14-7-2-3-10-16(14)15/h2-3,5-7,10-11,15,17,20H,4,8-9,12H2,1H3.
What are the key properties of 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol?
1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol has a molecular weight of 267.37 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-pyridinyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol is sourced from PubChem (CID 63773352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).