4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene

C14H16O — CID 67360409

IUPAC4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene
SMILESCOc1ccc2c(c1)C(=C1CC1)CCC2
InChIInChI=1S/C14H16O/c1-15-12-8-7-10-3-2-4-13(11-5-6-11)14(10)9-12/h7-9H,2-6H2,1H3
InChIKeyKCNMJBIBYZTMEZ-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.58
Rot. Bonds1

About 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene

4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene (PubChem CID 67360409) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene.

Molecular Properties

Compound Name4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene
PubChem CID67360409
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Name4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene
SMILESCOc1ccc2c(c1)C(=C1CC1)CCC2
InChIInChI=1S/C14H16O/c1-15-12-8-7-10-3-2-4-13(11-5-6-11)14(10)9-12/h7-9H,2-6H2,1H3
InChIKeyKCNMJBIBYZTMEZ-UHFFFAOYSA-N
XLogP3.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene?
The IUPAC name of 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene (CID 67360409) is 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene.
What is the SMILES notation for 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene?
The canonical SMILES for 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene is COc1ccc2c(c1)C(=C1CC1)CCC2.
What is the InChIKey of 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene?
The InChIKey is KCNMJBIBYZTMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O/c1-15-12-8-7-10-3-2-4-13(11-5-6-11)14(10)9-12/h7-9H,2-6H2,1H3.
What are the key properties of 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene?
4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene has a molecular weight of 200.28 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropylidene-6-methoxy-2,3-dihydro-1H-naphthalene is sourced from PubChem (CID 67360409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).