6-ethyl-2-methyl-3,4-dihydro-2H-chromene

C12H16O — CID 143125132

IUPAC6-ethyl-2-methyl-3,4-dihydro-2H-chromene
SMILESCCc1ccc2c(c1)CCC(C)O2
InChIInChI=1S/C12H16O/c1-3-10-5-7-12-11(8-10)6-4-9(2)13-12/h5,7-9H,3-4,6H2,1-2H3
InChIKeyXMNFJEUWDNHFEL-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.96
Rot. Bonds1

About 6-ethyl-2-methyl-3,4-dihydro-2H-chromene

6-ethyl-2-methyl-3,4-dihydro-2H-chromene (PubChem CID 143125132) has the molecular formula C12H16O and a molecular weight of 176.26 g/mol. Its IUPAC name is 6-ethyl-2-methyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name6-ethyl-2-methyl-3,4-dihydro-2H-chromene
PubChem CID143125132
Molecular FormulaC12H16O
Molecular Weight176.26 g/mol
Exact Mass176.12
IUPAC Name6-ethyl-2-methyl-3,4-dihydro-2H-chromene
SMILESCCc1ccc2c(c1)CCC(C)O2
InChIInChI=1S/C12H16O/c1-3-10-5-7-12-11(8-10)6-4-9(2)13-12/h5,7-9H,3-4,6H2,1-2H3
InChIKeyXMNFJEUWDNHFEL-UHFFFAOYSA-N
XLogP2.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methyl-3,4-dihydro-2H-chromen-6-yl)ethanesulfonyl chloride
CID 84713984
2,5-diethyl-2,3-dihydro-1-benzofuran
CID 19757400
2,2-dimethylpropane;ethane;(2R)-2-methyl-3,4-dihydro-2H-chromen-6-amine
CID 142100009
1-[1-(2-methyl-3,4-dihydro-2H-chromen-6-yl)cyclopropyl]ethanamine
CID 117335065
azane;(2R)-2-methyl-3,4-dihydro-2H-chromene
CID 174522322
6-(4-ethylphenyl)-7,8-difluoro-2-methyl-3,4-dihydro-2H-chromene
CID 69234280
(4-ethylphenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanone
CID 43297054
3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propanenitrile
CID 84770407
4-(2-methyl-3,4-dihydro-2H-chromen-7-yl)butanoic acid
CID 117340514
7-(fluoromethyl)-2,6-dimethyl-3,4-dihydro-2H-chromene
CID 89242615
N-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methyl]hydroxylamine
CID 82600111
5-benzyl-2-methyl-2,3-dihydro-1-benzofuran
CID 173314899

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyl-3,4-dihydro-2H-chromene?
The IUPAC name of 6-ethyl-2-methyl-3,4-dihydro-2H-chromene (CID 143125132) is 6-ethyl-2-methyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 6-ethyl-2-methyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 6-ethyl-2-methyl-3,4-dihydro-2H-chromene is CCc1ccc2c(c1)CCC(C)O2.
What is the InChIKey of 6-ethyl-2-methyl-3,4-dihydro-2H-chromene?
The InChIKey is XMNFJEUWDNHFEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O/c1-3-10-5-7-12-11(8-10)6-4-9(2)13-12/h5,7-9H,3-4,6H2,1-2H3.
What are the key properties of 6-ethyl-2-methyl-3,4-dihydro-2H-chromene?
6-ethyl-2-methyl-3,4-dihydro-2H-chromene has a molecular weight of 176.26 g/mol, XLogP of 2.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 143125132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).