2-cyclopropyl-7-methylnaphthalene

C14H14 — CID 176713070

IUPAC2-cyclopropyl-7-methylnaphthalene
SMILESCc1ccc2ccc(C3CC3)cc2c1
InChIInChI=1S/C14H14/c1-10-2-3-12-6-7-13(11-4-5-11)9-14(12)8-10/h2-3,6-9,11H,4-5H2,1H3
InChIKeyDMOBIXBUNBURBB-UHFFFAOYSA-N
MW182.27 g/mol
LogP4.03
Rot. Bonds1

About 2-cyclopropyl-7-methylnaphthalene

2-cyclopropyl-7-methylnaphthalene (PubChem CID 176713070) has the molecular formula C14H14 and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-cyclopropyl-7-methylnaphthalene.

Molecular Properties

Compound Name2-cyclopropyl-7-methylnaphthalene
PubChem CID176713070
Molecular FormulaC14H14
Molecular Weight182.27 g/mol
Exact Mass182.11
IUPAC Name2-cyclopropyl-7-methylnaphthalene
SMILESCc1ccc2ccc(C3CC3)cc2c1
InChIInChI=1S/C14H14/c1-10-2-3-12-6-7-13(11-4-5-11)9-14(12)8-10/h2-3,6-9,11H,4-5H2,1H3
InChIKeyDMOBIXBUNBURBB-UHFFFAOYSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-7-methylnaphthalene?
The IUPAC name of 2-cyclopropyl-7-methylnaphthalene (CID 176713070) is 2-cyclopropyl-7-methylnaphthalene.
What is the SMILES notation for 2-cyclopropyl-7-methylnaphthalene?
The canonical SMILES for 2-cyclopropyl-7-methylnaphthalene is Cc1ccc2ccc(C3CC3)cc2c1.
What is the InChIKey of 2-cyclopropyl-7-methylnaphthalene?
The InChIKey is DMOBIXBUNBURBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14/c1-10-2-3-12-6-7-13(11-4-5-11)9-14(12)8-10/h2-3,6-9,11H,4-5H2,1H3.
What are the key properties of 2-cyclopropyl-7-methylnaphthalene?
2-cyclopropyl-7-methylnaphthalene has a molecular weight of 182.27 g/mol, XLogP of 4.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-methylnaphthalene is sourced from PubChem (CID 176713070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).