1-methyl-6-propan-2-ylnaphthalene

C14H16 — CID 58126565

IUPAC1-methyl-6-propan-2-ylnaphthalene
SMILESCc1cccc2cc(C(C)C)ccc12
InChIInChI=1S/C14H16/c1-10(2)12-7-8-14-11(3)5-4-6-13(14)9-12/h4-10H,1-3H3
InChIKeyMJXSNJKRCRPAQY-UHFFFAOYSA-N
MW184.28 g/mol
LogP4.27
Rot. Bonds1

About 1-methyl-6-propan-2-ylnaphthalene

1-methyl-6-propan-2-ylnaphthalene (PubChem CID 58126565) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-methyl-6-propan-2-ylnaphthalene.

Molecular Properties

Compound Name1-methyl-6-propan-2-ylnaphthalene
PubChem CID58126565
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name1-methyl-6-propan-2-ylnaphthalene
SMILESCc1cccc2cc(C(C)C)ccc12
InChIInChI=1S/C14H16/c1-10(2)12-7-8-14-11(3)5-4-6-13(14)9-12/h4-10H,1-3H3
InChIKeyMJXSNJKRCRPAQY-UHFFFAOYSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,6-di(propan-2-yl)naphthalene
CID 3016596
2-(5-methylnaphthalen-2-yl)propanoic acid
CID 54247261
10-methyl-2-propan-2-ylphenanthrene
CID 613068
6-butan-2-yl-1-methylnaphthalene;1,4-dimethylnaphthalene;ethane;methane
CID 178128482
1,3-dimethylnaphthalene;1,3-di(propan-2-yl)benzene
CID 157212509
ethane;2-propan-2-ylnaphthalene
CID 142226111
7-(difluoromethyl)-1-methylnaphthalene
CID 118843150
2-propan-2-ylpentacene
CID 153380535
(6-propan-2-ylnaphthalen-1-yl) acetate
CID 66701669
6-tert-butyl-1-methylnaphthalene
CID 3019609
1,5-dimethyl-3-propan-2-ylnaphthalene
CID 102239796
2-methyl-1-(3-methylnaphthalen-2-yl)-6-propan-2-ylisoquinolin-2-ium
CID 155638091

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-propan-2-ylnaphthalene?
The IUPAC name of 1-methyl-6-propan-2-ylnaphthalene (CID 58126565) is 1-methyl-6-propan-2-ylnaphthalene.
What is the SMILES notation for 1-methyl-6-propan-2-ylnaphthalene?
The canonical SMILES for 1-methyl-6-propan-2-ylnaphthalene is Cc1cccc2cc(C(C)C)ccc12.
What is the InChIKey of 1-methyl-6-propan-2-ylnaphthalene?
The InChIKey is MJXSNJKRCRPAQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16/c1-10(2)12-7-8-14-11(3)5-4-6-13(14)9-12/h4-10H,1-3H3.
What are the key properties of 1-methyl-6-propan-2-ylnaphthalene?
1-methyl-6-propan-2-ylnaphthalene has a molecular weight of 184.28 g/mol, XLogP of 4.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-propan-2-ylnaphthalene is sourced from PubChem (CID 58126565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).