(3S)-1,3-dimethyl-2,3-dihydro-1H-indene

C11H14 — CID 143951833

IUPAC(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
SMILESCC1C[C@H](C)c2ccccc21
InChIInChI=1S/C11H14/c1-8-7-9(2)11-6-4-3-5-10(8)11/h3-6,8-9H,7H2,1-2H3/t8-,9?/m0/s1
InChIKeyIIJUYSSJMAITHJ-IENPIDJESA-N
MW146.23 g/mol
LogP3.30
Rot. Bonds

About (3S)-1,3-dimethyl-2,3-dihydro-1H-indene

(3S)-1,3-dimethyl-2,3-dihydro-1H-indene (PubChem CID 143951833) has the molecular formula C11H14 and a molecular weight of 146.23 g/mol. Its IUPAC name is (3S)-1,3-dimethyl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
PubChem CID143951833
Molecular FormulaC11H14
Molecular Weight146.23 g/mol
Exact Mass146.11
IUPAC Name(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
SMILESCC1C[C@H](C)c2ccccc21
InChIInChI=1S/C11H14/c1-8-7-9(2)11-6-4-3-5-10(8)11/h3-6,8-9H,7H2,1-2H3/t8-,9?/m0/s1
InChIKeyIIJUYSSJMAITHJ-IENPIDJESA-N
XLogP3.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-ol
CID 640582
(1S,3S)-3-methyl-2,3-dihydro-1H-inden-1-amine
CID 28502914
(1R)-1-methyl-3-phenyl-2,3-dihydro-1H-indene
CID 163676750
[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine
CID 58681536
3-methyl-2,3-dihydro-1H-indene-1-carbonitrile
CID 21040228
2-(3-methyl-2,3-dihydro-1H-inden-1-yl)phenol
CID 174602517
4-methyl-1,2,2a,3,4,8b-hexahydronaphtho[1,2-b]azete
CID 115420913
1,1,4-trimethyl-2a,3,4,8b-tetrahydrocyclobuta[a]naphthalen-2-one
CID 115420993
(1-amino-4-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)methanol
CID 115420649
[(1S,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl] acetate
CID 11961495
N-cyclohexyl-3-methyl-2,3-dihydro-1H-inden-1-amine
CID 53408548
4-methyl-2-methylsulfonyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420349

Frequently Asked Questions

What is the IUPAC name of (3S)-1,3-dimethyl-2,3-dihydro-1H-indene?
The IUPAC name of (3S)-1,3-dimethyl-2,3-dihydro-1H-indene (CID 143951833) is (3S)-1,3-dimethyl-2,3-dihydro-1H-indene.
What is the SMILES notation for (3S)-1,3-dimethyl-2,3-dihydro-1H-indene?
The canonical SMILES for (3S)-1,3-dimethyl-2,3-dihydro-1H-indene is CC1C[C@H](C)c2ccccc21.
What is the InChIKey of (3S)-1,3-dimethyl-2,3-dihydro-1H-indene?
The InChIKey is IIJUYSSJMAITHJ-IENPIDJESA-N. The full InChI is InChI=1S/C11H14/c1-8-7-9(2)11-6-4-3-5-10(8)11/h3-6,8-9H,7H2,1-2H3/t8-,9?/m0/s1.
What are the key properties of (3S)-1,3-dimethyl-2,3-dihydro-1H-indene?
(3S)-1,3-dimethyl-2,3-dihydro-1H-indene has a molecular weight of 146.23 g/mol, XLogP of 3.30, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1,3-dimethyl-2,3-dihydro-1H-indene is sourced from PubChem (CID 143951833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).