6-methyl-1-propylcyclohexa-1,3-diene

C10H16 — CID 123906774

IUPAC6-methyl-1-propylcyclohexa-1,3-diene
SMILESCCCC1=CC=CCC1C
InChIInChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h4-5,8-9H,3,6-7H2,1-2H3
InChIKeyUBGPDLWCTVGBPC-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.31
Rot. Bonds2

About 6-methyl-1-propylcyclohexa-1,3-diene

6-methyl-1-propylcyclohexa-1,3-diene (PubChem CID 123906774) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 6-methyl-1-propylcyclohexa-1,3-diene.

Molecular Properties

Compound Name6-methyl-1-propylcyclohexa-1,3-diene
PubChem CID123906774
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name6-methyl-1-propylcyclohexa-1,3-diene
SMILESCCCC1=CC=CCC1C
InChIInChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h4-5,8-9H,3,6-7H2,1-2H3
InChIKeyUBGPDLWCTVGBPC-UHFFFAOYSA-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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Related Compounds

1-ethyl-6-methylcyclohexa-1,3-diene
CID 91435039
2-(6-methylcyclohexa-1,3-dien-1-yl)ethanol
CID 155053244
4-[(1E,3E,7Z)-6-methyl-7-propylcycloocta-1,3,7-trien-1-yl]oxyaniline
CID 143097022
1-(6-methylcyclohexa-1,3-dien-1-yl)propan-2-amine
CID 143285714
3-ethyl-2-methyl-1-[2-methyl-3-(6-methylcyclohexa-1,3-dien-1-yl)propyl]-4-propylbenzene
CID 155697541
1-ethyl-6-propylcyclohexa-1,3-diene
CID 91233524
2-amino-3-(6-methylcyclohexa-1,3-dien-1-yl)propanoic acid
CID 149153499
(6R)-1-butan-2-yl-6-methylcyclohexa-1,3-diene
CID 142008819
2-ethylcyclohexa-2,4-dien-1-amine
CID 123185856
6-methyl-1-propan-2-ylcyclohexa-1,3-diene
CID 22481425
4-methylheptane;N-methyl-2-propylcyclohexa-2,4-dien-1-amine;propanal
CID 143122051
1-(6-methylcyclohexa-1,3-dien-1-yl)butylbenzene
CID 142113855

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-propylcyclohexa-1,3-diene?
The IUPAC name of 6-methyl-1-propylcyclohexa-1,3-diene (CID 123906774) is 6-methyl-1-propylcyclohexa-1,3-diene.
What is the SMILES notation for 6-methyl-1-propylcyclohexa-1,3-diene?
The canonical SMILES for 6-methyl-1-propylcyclohexa-1,3-diene is CCCC1=CC=CCC1C.
What is the InChIKey of 6-methyl-1-propylcyclohexa-1,3-diene?
The InChIKey is UBGPDLWCTVGBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h4-5,8-9H,3,6-7H2,1-2H3.
What are the key properties of 6-methyl-1-propylcyclohexa-1,3-diene?
6-methyl-1-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 6-methyl-1-propylcyclohexa-1,3-diene is sourced from PubChem (CID 123906774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).