4-ethyl-7-methyl-1H-indene;molecular hydrogen

C12H16 — CID 142066088

IUPAC4-ethyl-7-methyl-1H-indene;molecular hydrogen
SMILESCCc1ccc(C)c2c1C=CC2.[H][H]
InChIInChI=1S/C12H14.H2/c1-3-10-8-7-9(2)11-5-4-6-12(10)11;/h4,6-8H,3,5H2,1-2H3;1H
InChIKeyULDVUUMRICXTIR-UHFFFAOYSA-N
MW160.26 g/mol
LogP3.37
Rot. Bonds1

About 4-ethyl-7-methyl-1H-indene;molecular hydrogen

4-ethyl-7-methyl-1H-indene;molecular hydrogen (PubChem CID 142066088) has the molecular formula C12H16 and a molecular weight of 160.26 g/mol. Its IUPAC name is 4-ethyl-7-methyl-1H-indene;molecular hydrogen.

Molecular Properties

Compound Name4-ethyl-7-methyl-1H-indene;molecular hydrogen
PubChem CID142066088
Molecular FormulaC12H16
Molecular Weight160.26 g/mol
Exact Mass160.13
IUPAC Name4-ethyl-7-methyl-1H-indene;molecular hydrogen
SMILESCCc1ccc(C)c2c1C=CC2.[H][H]
InChIInChI=1S/C12H14.H2/c1-3-10-8-7-9(2)11-5-4-6-12(10)11;/h4,6-8H,3,5H2,1-2H3;1H
InChIKeyULDVUUMRICXTIR-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4-ethyl-7-methyl-1H-indene;molecular hydrogen 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

4,7-dimethyl-1H-indene
CID 157466302
7-ethyl-4-propyl-1H-indene
CID 57296911
butane;ethane;5-ethyl-8-methyl-1,2,3,4-tetrahydronaphthalene
CID 142179547
dimethyl-bis(7-methyl-3H-inden-4-yl)silane
CID 139707753
2-(7-methyl-2,3-dihydro-1H-inden-4-yl)acetic acid
CID 117281877
4-ethyl-7-methyl-2,3-dihydroinden-1-one
CID 18720358
1,2-diethyl-3,4-dimethylbenzene
CID 590292
1-ethyl-4-[(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methyl]naphthalene
CID 143195979
ethane;4-ethyl-1H-indene;2-methylnaphthalene;propane;dihydrate
CID 143603022
3-chloro-1-ethyl-2,4-dimethylbenzene
CID 141381436
2-ethyl-4-[2-(3-ethyl-4-methylphenyl)ethyl]-1-methylbenzene
CID 123325932
tetrakis(N,N-dimethylethanamine);ethane;bis(tetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),4,7(11),8,12,14-heptaene)
CID 161066548

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-7-methyl-1H-indene;molecular hydrogen?
The IUPAC name of 4-ethyl-7-methyl-1H-indene;molecular hydrogen (CID 142066088) is 4-ethyl-7-methyl-1H-indene;molecular hydrogen.
What is the SMILES notation for 4-ethyl-7-methyl-1H-indene;molecular hydrogen?
The canonical SMILES for 4-ethyl-7-methyl-1H-indene;molecular hydrogen is CCc1ccc(C)c2c1C=CC2.[H][H].
What is the InChIKey of 4-ethyl-7-methyl-1H-indene;molecular hydrogen?
The InChIKey is ULDVUUMRICXTIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14.H2/c1-3-10-8-7-9(2)11-5-4-6-12(10)11;/h4,6-8H,3,5H2,1-2H3;1H.
What are the key properties of 4-ethyl-7-methyl-1H-indene;molecular hydrogen?
4-ethyl-7-methyl-1H-indene;molecular hydrogen has a molecular weight of 160.26 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-7-methyl-1H-indene;molecular hydrogen is sourced from PubChem (CID 142066088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).