2-methyl-7-propylnaphthalene

C14H16 — CID 59912073

IUPAC2-methyl-7-propylnaphthalene
SMILESCCCc1ccc2ccc(C)cc2c1
InChIInChI=1S/C14H16/c1-3-4-12-6-8-13-7-5-11(2)9-14(13)10-12/h5-10H,3-4H2,1-2H3
InChIKeySHXDJQYIBIGEKK-UHFFFAOYSA-N
MW184.28 g/mol
LogP4.10
Rot. Bonds2

About 2-methyl-7-propylnaphthalene

2-methyl-7-propylnaphthalene (PubChem CID 59912073) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-methyl-7-propylnaphthalene.

Molecular Properties

Compound Name2-methyl-7-propylnaphthalene
PubChem CID59912073
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name2-methyl-7-propylnaphthalene
SMILESCCCc1ccc2ccc(C)cc2c1
InChIInChI=1S/C14H16/c1-3-4-12-6-8-13-7-5-11(2)9-14(13)10-12/h5-10H,3-4H2,1-2H3
InChIKeySHXDJQYIBIGEKK-UHFFFAOYSA-N
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-propylnaphthalene?
The IUPAC name of 2-methyl-7-propylnaphthalene (CID 59912073) is 2-methyl-7-propylnaphthalene.
What is the SMILES notation for 2-methyl-7-propylnaphthalene?
The canonical SMILES for 2-methyl-7-propylnaphthalene is CCCc1ccc2ccc(C)cc2c1.
What is the InChIKey of 2-methyl-7-propylnaphthalene?
The InChIKey is SHXDJQYIBIGEKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16/c1-3-4-12-6-8-13-7-5-11(2)9-14(13)10-12/h5-10H,3-4H2,1-2H3.
What are the key properties of 2-methyl-7-propylnaphthalene?
2-methyl-7-propylnaphthalene has a molecular weight of 184.28 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-propylnaphthalene is sourced from PubChem (CID 59912073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).