(5S)-1,5-dimethyl-6-methylidenecyclohexene

C9H14 — CID 163946198

IUPAC(5S)-1,5-dimethyl-6-methylidenecyclohexene
SMILESC=C1C(C)=CCC[C@@H]1C
InChIInChI=1S/C9H14/c1-7-5-4-6-8(2)9(7)3/h5,8H,3-4,6H2,1-2H3/t8-/m0/s1
InChIKeyRVHICPXGTPNKRU-QMMMGPOBSA-N
MW122.21 g/mol
LogP2.92
Rot. Bonds

About (5S)-1,5-dimethyl-6-methylidenecyclohexene

(5S)-1,5-dimethyl-6-methylidenecyclohexene (PubChem CID 163946198) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is (5S)-1,5-dimethyl-6-methylidenecyclohexene.

Molecular Properties

Compound Name(5S)-1,5-dimethyl-6-methylidenecyclohexene
PubChem CID163946198
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name(5S)-1,5-dimethyl-6-methylidenecyclohexene
SMILESC=C1C(C)=CCC[C@@H]1C
InChIInChI=1S/C9H14/c1-7-5-4-6-8(2)9(7)3/h5,8H,3-4,6H2,1-2H3/t8-/m0/s1
InChIKeyRVHICPXGTPNKRU-QMMMGPOBSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-dimethyl-5,6-dihydro-4H-indene
CID 139810166
(5S)-5-methylcyclopentene-1-carbaldehyde
CID 101259456
6-methyl-7-methylidenebicyclo[3.2.0]hept-1-ene
CID 163977963
3,7-dimethyl-2-propan-2-ylidenecyclohept-3-en-1-imine
CID 168914337
1-fluoro-3,7-dimethylcyclohepta-1,3-diene
CID 145318175
(3E)-N-methyl-6-(5-methyl-6-methylidenecyclohexen-1-yl)-4-propan-2-ylhepta-1,3-dien-2-amine
CID 155129175
1-methyl-2-methylidenecyclobutane
CID 20800914
2-hydroxy-6-methylcyclohex-2-en-1-one
CID 14494141
1-ethenyl-5-methylcyclohexene
CID 13382650
(3S)-3-methyl-2-methylidenecyclopentan-1-one
CID 11789153
1,5-dimethylcyclohexene
CID 520362
1-methyl-2,3-dimethylidenecycloheptane
CID 20744103

Frequently Asked Questions

What is the IUPAC name of (5S)-1,5-dimethyl-6-methylidenecyclohexene?
The IUPAC name of (5S)-1,5-dimethyl-6-methylidenecyclohexene (CID 163946198) is (5S)-1,5-dimethyl-6-methylidenecyclohexene.
What is the SMILES notation for (5S)-1,5-dimethyl-6-methylidenecyclohexene?
The canonical SMILES for (5S)-1,5-dimethyl-6-methylidenecyclohexene is C=C1C(C)=CCC[C@@H]1C.
What is the InChIKey of (5S)-1,5-dimethyl-6-methylidenecyclohexene?
The InChIKey is RVHICPXGTPNKRU-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H14/c1-7-5-4-6-8(2)9(7)3/h5,8H,3-4,6H2,1-2H3/t8-/m0/s1.
What are the key properties of (5S)-1,5-dimethyl-6-methylidenecyclohexene?
(5S)-1,5-dimethyl-6-methylidenecyclohexene has a molecular weight of 122.21 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1,5-dimethyl-6-methylidenecyclohexene is sourced from PubChem (CID 163946198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).