2-(1-methylcyclopropyl)naphthalene

C14H14 — CID 10511657

IUPAC2-(1-methylcyclopropyl)naphthalene
SMILESCC1(c2ccc3ccccc3c2)CC1
InChIInChI=1S/C14H14/c1-14(8-9-14)13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3
InChIKeyWYFCOKNYDNMNOW-UHFFFAOYSA-N
MW182.27 g/mol
LogP3.89
Rot. Bonds1

About 2-(1-methylcyclopropyl)naphthalene

2-(1-methylcyclopropyl)naphthalene (PubChem CID 10511657) has the molecular formula C14H14 and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-(1-methylcyclopropyl)naphthalene.

Molecular Properties

Compound Name2-(1-methylcyclopropyl)naphthalene
PubChem CID10511657
Molecular FormulaC14H14
Molecular Weight182.27 g/mol
Exact Mass182.11
IUPAC Name2-(1-methylcyclopropyl)naphthalene
SMILESCC1(c2ccc3ccccc3c2)CC1
InChIInChI=1S/C14H14/c1-14(8-9-14)13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3
InChIKeyWYFCOKNYDNMNOW-UHFFFAOYSA-N
XLogP3.89
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 ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylcyclopropyl)naphthalene?
The IUPAC name of 2-(1-methylcyclopropyl)naphthalene (CID 10511657) is 2-(1-methylcyclopropyl)naphthalene.
What is the SMILES notation for 2-(1-methylcyclopropyl)naphthalene?
The canonical SMILES for 2-(1-methylcyclopropyl)naphthalene is CC1(c2ccc3ccccc3c2)CC1.
What is the InChIKey of 2-(1-methylcyclopropyl)naphthalene?
The InChIKey is WYFCOKNYDNMNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14/c1-14(8-9-14)13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3.
What are the key properties of 2-(1-methylcyclopropyl)naphthalene?
2-(1-methylcyclopropyl)naphthalene has a molecular weight of 182.27 g/mol, XLogP of 3.89, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylcyclopropyl)naphthalene is sourced from PubChem (CID 10511657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).