(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol

C13H18O — CID 66059601

IUPAC(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
SMILESCCC1(CO)CCCc2ccccc21
InChIInChI=1S/C13H18O/c1-2-13(10-14)9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,14H,2,5,7,9-10H2,1H3
InChIKeyXYMMSMPZTUYOMR-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.66
Rot. Bonds2

About (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol

(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol (PubChem CID 66059601) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol.

Molecular Properties

Compound Name(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
PubChem CID66059601
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
SMILESCCC1(CO)CCCc2ccccc21
InChIInChI=1S/C13H18O/c1-2-13(10-14)9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,14H,2,5,7,9-10H2,1H3
InChIKeyXYMMSMPZTUYOMR-UHFFFAOYSA-N
XLogP2.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-diethyl-2,3-dihydro-1H-naphthalene
CID 520431
[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 66058133
1-(hydroxymethyl)-3,4-dihydro-2H-naphthalen-1-ol
CID 11084449
[1-(methylamino)-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 61054317
[1-[(2-methyltetrazol-5-yl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 107057773
[1-[(3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 66058551
[1-(hydroxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanol;[1-(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]methanol
CID 162091921
[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane
CID 106324106
[1-[(4-chloro-3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 107894915
4-(bromomethyl)-4-nonyl-2,3-dihydro-1H-naphthalene
CID 66047893
4-(bromomethyl)-4-heptyl-2,3-dihydro-1H-naphthalene
CID 66047892
[1-(2-methylbutyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 63521983

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The IUPAC name of (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol (CID 66059601) is (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol.
What is the SMILES notation for (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The canonical SMILES for (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol is CCC1(CO)CCCc2ccccc21.
What is the InChIKey of (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The InChIKey is XYMMSMPZTUYOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-2-13(10-14)9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,14H,2,5,7,9-10H2,1H3.
What are the key properties of (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol has a molecular weight of 190.29 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol is sourced from PubChem (CID 66059601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).