5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane

C14H17N — CID 145072090

IUPAC5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane
SMILESC=CC1=C(C=C)c2cccnc2C1.CC
InChIInChI=1S/C12H11N.C2H6/c1-3-9-8-12-11(10(9)4-2)6-5-7-13-12;1-2/h3-7H,1-2,8H2;1-2H3
InChIKeyAVIQOSVHYITLJR-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.79
Rot. Bonds2

About 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane

5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane (PubChem CID 145072090) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane.

Molecular Properties

Compound Name5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane
PubChem CID145072090
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane
SMILESC=CC1=C(C=C)c2cccnc2C1.CC
InChIInChI=1S/C12H11N.C2H6/c1-3-9-8-12-11(10(9)4-2)6-5-7-13-12;1-2/h3-7H,1-2,8H2;1-2H3
InChIKeyAVIQOSVHYITLJR-UHFFFAOYSA-N
XLogP3.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;5-ethenyl-7,8-dihydroquinoline
CID 177360263
2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole
CID 144597079
5,6,7,8-tetramethyl-9H-indeno[2,1-b]pyridine
CID 157054008
2,3-bis(ethenyl)-4,5-dihydrooxepino[2,3-b]pyridine;methanamine
CID 165410288
5,6-dihydro-1,7-phenanthroline
CID 69016308
5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine
CID 143815729
5-methyl-5,9-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene
CID 58931549
ethane;2-ethenyl-7-methyl-3-[(Z)-prop-1-enyl]-1H-indene
CID 143520012
3,4-dimethyl-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 159070355
5-ethylidene-7,8-dihydro-6H-quinoline
CID 164582583
ethane;3-ethenyl-2-methylsulfanylpyridine
CID 157029026
ethane;1,2,4-tris(ethenyl)-3-[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 142480313

Frequently Asked Questions

What is the IUPAC name of 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane?
The IUPAC name of 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane (CID 145072090) is 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane.
What is the SMILES notation for 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane?
The canonical SMILES for 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane is C=CC1=C(C=C)c2cccnc2C1.CC.
What is the InChIKey of 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane?
The InChIKey is AVIQOSVHYITLJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N.C2H6/c1-3-9-8-12-11(10(9)4-2)6-5-7-13-12;1-2/h3-7H,1-2,8H2;1-2H3.
What are the key properties of 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane?
5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane has a molecular weight of 199.30 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(ethenyl)-7H-cyclopenta[b]pyridine;ethane is sourced from PubChem (CID 145072090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).