2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol

C18H20O — CID 174473349

IUPAC2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol
SMILESCC1=CC(C)=C(c2ccc3ccccc3c2)C1.CO
InChIInChI=1S/C17H16.CH4O/c1-12-9-13(2)17(10-12)16-8-7-14-5-3-4-6-15(14)11-16;1-2/h3-9,11H,10H2,1-2H3;2H,1H3
InChIKeyDJOLCIIVSJETRA-UHFFFAOYSA-N
MW252.36 g/mol
LogP4.57
Rot. Bonds1

About 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol

2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol (PubChem CID 174473349) has the molecular formula C18H20O and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol.

Molecular Properties

Compound Name2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol
PubChem CID174473349
Molecular FormulaC18H20O
Molecular Weight252.36 g/mol
Exact Mass252.15
IUPAC Name2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol
SMILESCC1=CC(C)=C(c2ccc3ccccc3c2)C1.CO
InChIInChI=1S/C17H16.CH4O/c1-12-9-13(2)17(10-12)16-8-7-14-5-3-4-6-15(14)11-16;1-2/h3-9,11H,10H2,1-2H3;2H,1H3
InChIKeyDJOLCIIVSJETRA-UHFFFAOYSA-N
XLogP4.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methyl-3H-inden-4-yl)naphthalene
CID 158464529
N-[(E)-[2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)phenyl]methylideneamino]naphthalen-2-amine
CID 23016126
5,11,17,23-tetranaphthalen-2-ylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaene
CID 123783925
3-(2,4-dimethylcyclopenta-1,3-dien-1-yl)-1-naphthalen-2-ylpropan-1-one
CID 174473380
2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)chromen-4-one;naphthalene
CID 174460272
benzo[f]azulene
CID 13065869
[2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalen-1-yl]-diphenylmethanol;titanium;dihydrochloride
CID 87494760
3-methyl-2H-anthracen-1-one
CID 141307258
2-[3-(4-methylphenyl)-5-(4-phenylphenyl)phenyl]naphthalene
CID 156673302
2-(2,3,5,6-tetramethylphenyl)naphthalene
CID 90733282
2,3-dimethyl-6-naphthalen-2-yl-1H-cyclopenta[b]naphthalene
CID 58536043
4,6-dimethyl-2-naphthalen-2-ylpyrimidine-5-carboxylic acid
CID 62745589

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol?
The IUPAC name of 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol (CID 174473349) is 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol.
What is the SMILES notation for 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol?
The canonical SMILES for 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol is CC1=CC(C)=C(c2ccc3ccccc3c2)C1.CO.
What is the InChIKey of 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol?
The InChIKey is DJOLCIIVSJETRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16.CH4O/c1-12-9-13(2)17(10-12)16-8-7-14-5-3-4-6-15(14)11-16;1-2/h3-9,11H,10H2,1-2H3;2H,1H3.
What are the key properties of 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol?
2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol has a molecular weight of 252.36 g/mol, XLogP of 4.57, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylcyclopenta-1,3-dien-1-yl)naphthalene;methanol is sourced from PubChem (CID 174473349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).