1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene

C18H24O2 — CID 15880818

IUPAC1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene
SMILESCOC(=C(C1(C)CC1)C1(C)CC1)c1cccc(OC)c1
InChIInChI=1S/C18H24O2/c1-17(8-9-17)16(18(2)10-11-18)15(20-4)13-6-5-7-14(12-13)19-3/h5-7,12H,8-11H2,1-4H3
InChIKeyVIJLIRJFKDKPCO-UHFFFAOYSA-N
MW272.39 g/mol
LogP4.65
Rot. Bonds5

About 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene

1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene (PubChem CID 15880818) has the molecular formula C18H24O2 and a molecular weight of 272.39 g/mol. Its IUPAC name is 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene.

Molecular Properties

Compound Name1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene
PubChem CID15880818
Molecular FormulaC18H24O2
Molecular Weight272.39 g/mol
Exact Mass272.18
IUPAC Name1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene
SMILESCOC(=C(C1(C)CC1)C1(C)CC1)c1cccc(OC)c1
InChIInChI=1S/C18H24O2/c1-17(8-9-17)16(18(2)10-11-18)15(20-4)13-6-5-7-14(12-13)19-3/h5-7,12H,8-11H2,1-4H3
InChIKeyVIJLIRJFKDKPCO-UHFFFAOYSA-N
XLogP4.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

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CID 177443741
N-[1-(hydroxymethyl)cyclopropyl]-3-methoxybenzamide
CID 115764584
1-(3-methoxyphenyl)ethylideneazanium
CID 135086476
(3-methoxyphenyl)-(2-methyloxan-2-yl)methanone
CID 80685429
1-(2-tert-butyl-1-methoxy-5,5-dimethylhex-1-enyl)-3-methoxybenzene
CID 54004902
1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43151448
3-methoxy-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]benzamide
CID 110359279
(3S)-1-(3-methoxybenzoyl)-3-methylpyrrolidine-3-carboxylic acid
CID 95020177
1-(3-methoxyphenyl)-N-[1-(3-methoxyphenyl)ethylideneamino]ethanimine
CID 791623
1-(1-iodoethenyl)-3-methoxybenzene
CID 102579416
N-[[1-(chloromethyl)cyclohexyl]methyl]-3-methoxybenzamide
CID 103969532

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene?
The IUPAC name of 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene (CID 15880818) is 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene.
What is the SMILES notation for 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene?
The canonical SMILES for 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene is COC(=C(C1(C)CC1)C1(C)CC1)c1cccc(OC)c1.
What is the InChIKey of 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene?
The InChIKey is VIJLIRJFKDKPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O2/c1-17(8-9-17)16(18(2)10-11-18)15(20-4)13-6-5-7-14(12-13)19-3/h5-7,12H,8-11H2,1-4H3.
What are the key properties of 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene?
1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene has a molecular weight of 272.39 g/mol, XLogP of 4.65, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[1-methoxy-2,2-bis(1-methylcyclopropyl)ethenyl]benzene is sourced from PubChem (CID 15880818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).