3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene

C16H16O2 — CID 146276535

IUPAC3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene
SMILESCOc1cccc(C2COc3ccccc3C2)c1
InChIInChI=1S/C16H16O2/c1-17-15-7-4-6-12(10-15)14-9-13-5-2-3-8-16(13)18-11-14/h2-8,10,14H,9,11H2,1H3
InChIKeyXIUIUYITTOZINH-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.41
Rot. Bonds2

About 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene

3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene (PubChem CID 146276535) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene
PubChem CID146276535
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene
SMILESCOc1cccc(C2COc3ccccc3C2)c1
InChIInChI=1S/C16H16O2/c1-17-15-7-4-6-12(10-15)14-9-13-5-2-3-8-16(13)18-11-14/h2-8,10,14H,9,11H2,1H3
InChIKeyXIUIUYITTOZINH-UHFFFAOYSA-N
XLogP3.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(4-methoxyphenyl)-3,4-dihydro-2H-chromene
CID 15536179
(3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromene
CID 100986544
3-(3-methoxyphenyl)oxetane
CID 130113867
(4R)-4-(3-bromophenyl)-2,3,4,5-tetrahydro-1-benzoxepine;(4R)-4-(3-methoxyphenyl)-2,3,4,5-tetrahydro-1-benzoxepine;(4R)-4-(3-methylphenyl)-2,3,4,5-tetrahydro-1-benzoxepine;(4R)-4-(4-methylphenyl)-2,3,4,5-tetrahydro-1-benzoxepine;(4R)-4-phenyl-2,3,4,5-tetrahydro-1-benzoxepine
CID 158636063
(3S)-N-(3-methoxyphenyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 40840529
7-methoxy-3-phenyl-3,4-dihydro-2H-chromen-6-ol
CID 15628202
1-cyclopropyl-3-methoxybenzene;methane
CID 169265234
1-methoxy-3-(3-methylidenecyclobutyl)benzene
CID 156818546
carbanide;1-cyclopropyl-3-methoxybenzene;tungsten
CID 169265135
1-cyclopropyl-3-methoxybenzene;methanol
CID 70274289
(2R)-2-(3-methoxyphenyl)oxirane
CID 22882163
2-(3-methoxyphenyl)-2,5-dihydro-1-benzoxepine
CID 75985500

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene?
The IUPAC name of 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene (CID 146276535) is 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene.
What is the SMILES notation for 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene?
The canonical SMILES for 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene is COc1cccc(C2COc3ccccc3C2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene?
The InChIKey is XIUIUYITTOZINH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-17-15-7-4-6-12(10-15)14-9-13-5-2-3-8-16(13)18-11-14/h2-8,10,14H,9,11H2,1H3.
What are the key properties of 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene?
3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene has a molecular weight of 240.30 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-3,4-dihydro-2H-chromene is sourced from PubChem (CID 146276535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).