1-methoxy-2-propylnaphthalene

C14H16O — CID 19091368

IUPAC1-methoxy-2-propylnaphthalene
SMILESCCCc1ccc2ccccc2c1OC
InChIInChI=1S/C14H16O/c1-3-6-12-10-9-11-7-4-5-8-13(11)14(12)15-2/h4-5,7-10H,3,6H2,1-2H3
InChIKeyBYDLCKINPVCXFP-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.80
Rot. Bonds3

About 1-methoxy-2-propylnaphthalene

1-methoxy-2-propylnaphthalene (PubChem CID 19091368) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-methoxy-2-propylnaphthalene.

Molecular Properties

Compound Name1-methoxy-2-propylnaphthalene
PubChem CID19091368
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Name1-methoxy-2-propylnaphthalene
SMILESCCCc1ccc2ccccc2c1OC
InChIInChI=1S/C14H16O/c1-3-6-12-10-9-11-7-4-5-8-13(11)14(12)15-2/h4-5,7-10H,3,6H2,1-2H3
InChIKeyBYDLCKINPVCXFP-UHFFFAOYSA-N
XLogP3.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-propylnaphthalene?
The IUPAC name of 1-methoxy-2-propylnaphthalene (CID 19091368) is 1-methoxy-2-propylnaphthalene.
What is the SMILES notation for 1-methoxy-2-propylnaphthalene?
The canonical SMILES for 1-methoxy-2-propylnaphthalene is CCCc1ccc2ccccc2c1OC.
What is the InChIKey of 1-methoxy-2-propylnaphthalene?
The InChIKey is BYDLCKINPVCXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O/c1-3-6-12-10-9-11-7-4-5-8-13(11)14(12)15-2/h4-5,7-10H,3,6H2,1-2H3.
What are the key properties of 1-methoxy-2-propylnaphthalene?
1-methoxy-2-propylnaphthalene has a molecular weight of 200.28 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-propylnaphthalene is sourced from PubChem (CID 19091368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).