4-methylidene-1H-azulene

C11H10 — CID 144559189

IUPAC4-methylidene-1H-azulene
SMILESC=C1C=CC=CC2=C1C=CC2
InChIInChI=1S/C11H10/c1-9-5-2-3-6-10-7-4-8-11(9)10/h2-6,8H,1,7H2
InChIKeyYUTOUSXHOJSGDP-UHFFFAOYSA-N
MW142.20 g/mol
LogP2.93
Rot. Bonds

About 4-methylidene-1H-azulene

4-methylidene-1H-azulene (PubChem CID 144559189) has the molecular formula C11H10 and a molecular weight of 142.20 g/mol. Its IUPAC name is 4-methylidene-1H-azulene.

Molecular Properties

Compound Name4-methylidene-1H-azulene
PubChem CID144559189
Molecular FormulaC11H10
Molecular Weight142.20 g/mol
Exact Mass142.08
IUPAC Name4-methylidene-1H-azulene
SMILESC=C1C=CC=CC2=C1C=CC2
InChIInChI=1S/C11H10/c1-9-5-2-3-6-10-7-4-8-11(9)10/h2-6,8H,1,7H2
InChIKeyYUTOUSXHOJSGDP-UHFFFAOYSA-N
XLogP2.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

8,9-dimethylidenebicyclo[4.4.1]undeca-1(10),2,4,6-tetraene
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CID 175171179
2-methylidenecyclopent-3-en-1-one
CID 15805386
(5Z,7Z)-4-methylidenebicyclo[8.2.0]dodeca-1(10),2,5,7-tetraene
CID 174278772
1-methylidene-7-methylidene-4H-indene
CID 137125426
6-methylidenecyclohexa-2,4-diene-1-selone
CID 14249672
1H-cyclopenta[8]annulene;2H-triazepine
CID 174715149
(21E)-21-cyclohexa-2,4-dien-1-ylidene-23-methylidene-2,11,20,22,24,32,33,34-octazaheptacyclo[23.6.1.13,10.112,19.04,9.013,18.026,31]tetratriacontane
CID 175633869
2-cyclohexa-2,4-dien-1-ylidene-1,3-dithiane
CID 10936596
6-cyclohexa-2,4-dien-1-ylidene-1-methylidenepyrimidin-1-ium
CID 159042161
1,6-dihydroazulene
CID 10898747
1,2-bis(ethenyl)-3-methylidenecyclohexa-1,4-diene
CID 145268237

Frequently Asked Questions

What is the IUPAC name of 4-methylidene-1H-azulene?
The IUPAC name of 4-methylidene-1H-azulene (CID 144559189) is 4-methylidene-1H-azulene.
What is the SMILES notation for 4-methylidene-1H-azulene?
The canonical SMILES for 4-methylidene-1H-azulene is C=C1C=CC=CC2=C1C=CC2.
What is the InChIKey of 4-methylidene-1H-azulene?
The InChIKey is YUTOUSXHOJSGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10/c1-9-5-2-3-6-10-7-4-8-11(9)10/h2-6,8H,1,7H2.
What are the key properties of 4-methylidene-1H-azulene?
4-methylidene-1H-azulene has a molecular weight of 142.20 g/mol, XLogP of 2.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-1H-azulene is sourced from PubChem (CID 144559189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).