2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene

C11H16 — CID 145327169

IUPAC2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene
SMILESC/C=C(/CC)C1=CCCC=C1
InChIInChI=1S/C11H16/c1-3-10(4-2)11-8-6-5-7-9-11/h3,6,8-9H,4-5,7H2,1-2H3/b10-3-
InChIKeyJDBXSSSSRKGEJA-KMKOMSMNSA-N
MW148.25 g/mol
LogP3.62
Rot. Bonds2

About 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene

2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene (PubChem CID 145327169) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene.

Molecular Properties

Compound Name2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene
PubChem CID145327169
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene
SMILESC/C=C(/CC)C1=CCCC=C1
InChIInChI=1S/C11H16/c1-3-10(4-2)11-8-6-5-7-9-11/h3,6,8-9H,4-5,7H2,1-2H3/b10-3-
InChIKeyJDBXSSSSRKGEJA-KMKOMSMNSA-N
XLogP3.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(Z)-2-cyclohepta-1,6-dien-1-yl-N-methylbut-1-en-1-amine
CID 142246502
5-methyl-2-pent-2-en-3-ylcyclohexa-1,3-diene
CID 123584531
di(cyclohexa-1,5-dien-1-yl)methanone;ethane
CID 144664025
methanol;2-(3-methylbuta-1,3-dien-2-yl)cyclohexa-1,3-diene
CID 164543952
N'-methylcyclohexa-1,5-diene-1-carboximidamide
CID 144914796
1-cyclohexa-1,5-dien-1-yl-2,2-dimethylpropan-1-one
CID 19747828
methanol;2-methylcyclohexa-1,3-diene;propane
CID 142947667
(1R)-1-cyclohexa-1,5-dien-1-ylethanol
CID 101132775
N-but-1-en-2-yl-4-(1-cyclohexa-1,5-dien-1-ylethenyl)aniline
CID 143494911
(Z)-1-cyclohexa-1,5-dien-1-yl-N'-methylethene-1,2-diamine;propan-2-amine
CID 143111173
2-[(3E,5Z)-hepta-3,5-dien-3-yl]oxycyclohexa-1,3-diene
CID 89229948
(2E,4E)-1-cyclohexa-1,5-dien-1-yl-2,5,6-trimethylnona-2,4-dien-1-one;ethane
CID 142848737

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene?
The IUPAC name of 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene (CID 145327169) is 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene.
What is the SMILES notation for 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene?
The canonical SMILES for 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene is C/C=C(/CC)C1=CCCC=C1.
What is the InChIKey of 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene?
The InChIKey is JDBXSSSSRKGEJA-KMKOMSMNSA-N. The full InChI is InChI=1S/C11H16/c1-3-10(4-2)11-8-6-5-7-9-11/h3,6,8-9H,4-5,7H2,1-2H3/b10-3-.
What are the key properties of 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene?
2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene has a molecular weight of 148.25 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-pent-2-en-3-yl]cyclohexa-1,3-diene is sourced from PubChem (CID 145327169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).