2,3-diethyl-1-methyl-4-propylnaphthalene

C18H24 — CID 139700920

IUPAC2,3-diethyl-1-methyl-4-propylnaphthalene
SMILESCCCc1c(CC)c(CC)c(C)c2ccccc12
InChIInChI=1S/C18H24/c1-5-10-17-15(7-3)14(6-2)13(4)16-11-8-9-12-18(16)17/h8-9,11-12H,5-7,10H2,1-4H3
InChIKeyHKDHRMXBIOFIJT-UHFFFAOYSA-N
MW240.39 g/mol
LogP5.23
Rot. Bonds4

About 2,3-diethyl-1-methyl-4-propylnaphthalene

2,3-diethyl-1-methyl-4-propylnaphthalene (PubChem CID 139700920) has the molecular formula C18H24 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2,3-diethyl-1-methyl-4-propylnaphthalene.

Molecular Properties

Compound Name2,3-diethyl-1-methyl-4-propylnaphthalene
PubChem CID139700920
Molecular FormulaC18H24
Molecular Weight240.39 g/mol
Exact Mass240.19
IUPAC Name2,3-diethyl-1-methyl-4-propylnaphthalene
SMILESCCCc1c(CC)c(CC)c(C)c2ccccc12
InChIInChI=1S/C18H24/c1-5-10-17-15(7-3)14(6-2)13(4)16-11-8-9-12-18(16)17/h8-9,11-12H,5-7,10H2,1-4H3
InChIKeyHKDHRMXBIOFIJT-UHFFFAOYSA-N
XLogP5.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.39
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,3-diethyl-1,4-dimethylnaphthalene
CID 59270753
ethane;9-methyl-10-propylanthracene
CID 144649779
9-butyl-10-methylanthracene
CID 22754688
6,11-dibutyl-1,2,3,4-tetraethyltetracene
CID 58766221
9,10-dibutylanthracene
CID 605822
3-ethyl-1-methyl-4-propylisoquinoline
CID 153439364
1,2,3,4,6,11-hexabutyltetracene
CID 102079773
9-ethyl-10-[(10-ethylanthracen-9-yl)methyl]anthracene
CID 59194323
4-methyl-2-phenyl-3-propylquinoline
CID 39902639
1,4-dimethylidene-2,3-dipropylnaphthalene
CID 178049562
CID 90280951
CID 90280951
1-methyl-3,4-dipropylisoquinoline
CID 44606949

Frequently Asked Questions

What is the IUPAC name of 2,3-diethyl-1-methyl-4-propylnaphthalene?
The IUPAC name of 2,3-diethyl-1-methyl-4-propylnaphthalene (CID 139700920) is 2,3-diethyl-1-methyl-4-propylnaphthalene.
What is the SMILES notation for 2,3-diethyl-1-methyl-4-propylnaphthalene?
The canonical SMILES for 2,3-diethyl-1-methyl-4-propylnaphthalene is CCCc1c(CC)c(CC)c(C)c2ccccc12.
What is the InChIKey of 2,3-diethyl-1-methyl-4-propylnaphthalene?
The InChIKey is HKDHRMXBIOFIJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24/c1-5-10-17-15(7-3)14(6-2)13(4)16-11-8-9-12-18(16)17/h8-9,11-12H,5-7,10H2,1-4H3.
What are the key properties of 2,3-diethyl-1-methyl-4-propylnaphthalene?
2,3-diethyl-1-methyl-4-propylnaphthalene has a molecular weight of 240.39 g/mol, XLogP of 5.23, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethyl-1-methyl-4-propylnaphthalene is sourced from PubChem (CID 139700920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).