1,4-dimethylidene-2,3-dipropylnaphthalene

C18H22 — CID 178049562

IUPAC1,4-dimethylidene-2,3-dipropylnaphthalene
SMILESC=c1c(CCC)c(CCC)c(=C)c2ccccc12
InChIInChI=1S/C18H22/c1-5-9-15-13(3)17-11-7-8-12-18(17)14(4)16(15)10-6-2/h7-8,11-12H,3-6,9-10H2,1-2H3
InChIKeyWLJJQAKTWBDDBP-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.57
Rot. Bonds4

About 1,4-dimethylidene-2,3-dipropylnaphthalene

1,4-dimethylidene-2,3-dipropylnaphthalene (PubChem CID 178049562) has the molecular formula C18H22 and a molecular weight of 238.37 g/mol. Its IUPAC name is 1,4-dimethylidene-2,3-dipropylnaphthalene.

Molecular Properties

Compound Name1,4-dimethylidene-2,3-dipropylnaphthalene
PubChem CID178049562
Molecular FormulaC18H22
Molecular Weight238.37 g/mol
Exact Mass238.17
IUPAC Name1,4-dimethylidene-2,3-dipropylnaphthalene
SMILESC=c1c(CCC)c(CCC)c(=C)c2ccccc12
InChIInChI=1S/C18H22/c1-5-9-15-13(3)17-11-7-8-12-18(17)14(4)16(15)10-6-2/h7-8,11-12H,3-6,9-10H2,1-2H3
InChIKeyWLJJQAKTWBDDBP-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1,2,3,4-tetrapropylanthracene
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9,10-dibutylanthracene
CID 605822
4-methyl-2-phenyl-3-propylquinoline
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2-(2-phenylphenyl)-1-propylnaphthalene
CID 173154100
2,3-bis(ethenyl)-1-propylnaphthalene
CID 143956206
methanamine;1-propylnaphthalene
CID 174438724
1-methyl-3,4-dipropylisoquinoline
CID 44606949
3-propyl-1-benzothiophen-2-ol
CID 69483518
3-phenyl-4-propylisochromen-1-one
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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylidene-2,3-dipropylnaphthalene?
The IUPAC name of 1,4-dimethylidene-2,3-dipropylnaphthalene (CID 178049562) is 1,4-dimethylidene-2,3-dipropylnaphthalene.
What is the SMILES notation for 1,4-dimethylidene-2,3-dipropylnaphthalene?
The canonical SMILES for 1,4-dimethylidene-2,3-dipropylnaphthalene is C=c1c(CCC)c(CCC)c(=C)c2ccccc12.
What is the InChIKey of 1,4-dimethylidene-2,3-dipropylnaphthalene?
The InChIKey is WLJJQAKTWBDDBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22/c1-5-9-15-13(3)17-11-7-8-12-18(17)14(4)16(15)10-6-2/h7-8,11-12H,3-6,9-10H2,1-2H3.
What are the key properties of 1,4-dimethylidene-2,3-dipropylnaphthalene?
1,4-dimethylidene-2,3-dipropylnaphthalene has a molecular weight of 238.37 g/mol, XLogP of 3.57, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylidene-2,3-dipropylnaphthalene is sourced from PubChem (CID 178049562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).