3,4-dihydro-2H-chromene;1H-indene

C18H18O — CID 66618736

IUPAC3,4-dihydro-2H-chromene;1H-indene
SMILESC1=Cc2ccccc2C1.c1ccc2c(c1)CCCO2
InChIInChI=1S/C9H10O.C9H8/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-5-9-7-3-6-8(9)4-1/h1-2,4,6H,3,5,7H2;1-6H,7H2
InChIKeyLFIVUPGZYYBPKC-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.27
Rot. Bonds

About 3,4-dihydro-2H-chromene;1H-indene

3,4-dihydro-2H-chromene;1H-indene (PubChem CID 66618736) has the molecular formula C18H18O and a molecular weight of 250.34 g/mol. Its IUPAC name is 3,4-dihydro-2H-chromene;1H-indene.

Molecular Properties

Compound Name3,4-dihydro-2H-chromene;1H-indene
PubChem CID66618736
Molecular FormulaC18H18O
Molecular Weight250.34 g/mol
Exact Mass250.14
IUPAC Name3,4-dihydro-2H-chromene;1H-indene
SMILESC1=Cc2ccccc2C1.c1ccc2c(c1)CCCO2
InChIInChI=1S/C9H10O.C9H8/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-5-9-7-3-6-8(9)4-1/h1-2,4,6H,3,5,7H2;1-6H,7H2
InChIKeyLFIVUPGZYYBPKC-UHFFFAOYSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3,4-dihydro-2H-chromene;1H-indene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dihydro-2H-chromene;ethane
CID 91076984
3,4-dihydro-2H-chromene;hydron;iron;lanthanum
CID 175145681
3,4-dihydro-2H-chromene;naphthalene
CID 144745299
2-oxatricyclo[20.4.0.09,14]hexacosa-1(26),9,11,13,22,24-hexaene
CID 153343499
3,4-dihydro-2H-chromene;formaldehyde
CID 142487263
3,4-dihydro-2H-chromene;N,N-dimethylmethanamine
CID 174740760
strontium;3,4-dihydro-2H-chromene;hydride;oxolead
CID 173450529
1H-indene;methane
CID 22114429
1H-indene;methane
CID 157370172
copper;1H-indene
CID 175216856
2,3-dihydro-1H-indene;1H-indene;naphthalene
CID 161039487
benzene;1H-indene;naphthalene;1,2,3,4-tetrahydronaphthalene
CID 160913528

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-chromene;1H-indene?
The IUPAC name of 3,4-dihydro-2H-chromene;1H-indene (CID 66618736) is 3,4-dihydro-2H-chromene;1H-indene.
What is the SMILES notation for 3,4-dihydro-2H-chromene;1H-indene?
The canonical SMILES for 3,4-dihydro-2H-chromene;1H-indene is C1=Cc2ccccc2C1.c1ccc2c(c1)CCCO2.
What is the InChIKey of 3,4-dihydro-2H-chromene;1H-indene?
The InChIKey is LFIVUPGZYYBPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O.C9H8/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-5-9-7-3-6-8(9)4-1/h1-2,4,6H,3,5,7H2;1-6H,7H2.
What are the key properties of 3,4-dihydro-2H-chromene;1H-indene?
3,4-dihydro-2H-chromene;1H-indene has a molecular weight of 250.34 g/mol, XLogP of 4.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-chromene;1H-indene is sourced from PubChem (CID 66618736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).