(6R)-1-methyl-6-propylcyclohexa-1,3-diene

C10H16 — CID 163989420

IUPAC(6R)-1-methyl-6-propylcyclohexa-1,3-diene
SMILESCCC[C@@H]1CC=CC=C1C
InChIInChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7,10H,3,6,8H2,1-2H3/t10-/m1/s1
InChIKeyTZHCIZMALMMOCA-SNVBAGLBSA-N
MW136.24 g/mol
LogP3.31
Rot. Bonds2

About (6R)-1-methyl-6-propylcyclohexa-1,3-diene

(6R)-1-methyl-6-propylcyclohexa-1,3-diene (PubChem CID 163989420) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (6R)-1-methyl-6-propylcyclohexa-1,3-diene.

Molecular Properties

Compound Name(6R)-1-methyl-6-propylcyclohexa-1,3-diene
PubChem CID163989420
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(6R)-1-methyl-6-propylcyclohexa-1,3-diene
SMILESCCC[C@@H]1CC=CC=C1C
InChIInChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7,10H,3,6,8H2,1-2H3/t10-/m1/s1
InChIKeyTZHCIZMALMMOCA-SNVBAGLBSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (6R)-1-methyl-6-propylcyclohexa-1,3-diene?
The IUPAC name of (6R)-1-methyl-6-propylcyclohexa-1,3-diene (CID 163989420) is (6R)-1-methyl-6-propylcyclohexa-1,3-diene.
What is the SMILES notation for (6R)-1-methyl-6-propylcyclohexa-1,3-diene?
The canonical SMILES for (6R)-1-methyl-6-propylcyclohexa-1,3-diene is CCC[C@@H]1CC=CC=C1C.
What is the InChIKey of (6R)-1-methyl-6-propylcyclohexa-1,3-diene?
The InChIKey is TZHCIZMALMMOCA-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7,10H,3,6,8H2,1-2H3/t10-/m1/s1.
What are the key properties of (6R)-1-methyl-6-propylcyclohexa-1,3-diene?
(6R)-1-methyl-6-propylcyclohexa-1,3-diene has a molecular weight of 136.24 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1-methyl-6-propylcyclohexa-1,3-diene is sourced from PubChem (CID 163989420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).