2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine

C13H15N — CID 142222929

IUPAC2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESC=Cc1nc2c(c(C)c1C=C)CCC2
InChIInChI=1S/C13H15N/c1-4-10-9(3)11-7-6-8-13(11)14-12(10)5-2/h4-5H,1-2,6-8H2,3H3
InChIKeyYZOXAJYOTKUOOO-UHFFFAOYSA-N
MW185.27 g/mol
LogP3.16
Rot. Bonds2

About 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine

2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 142222929) has the molecular formula C13H15N and a molecular weight of 185.27 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID142222929
Molecular FormulaC13H15N
Molecular Weight185.27 g/mol
Exact Mass185.12
IUPAC Name2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESC=Cc1nc2c(c(C)c1C=C)CCC2
InChIInChI=1S/C13H15N/c1-4-10-9(3)11-7-6-8-13(11)14-12(10)5-2/h4-5H,1-2,6-8H2,3H3
InChIKeyYZOXAJYOTKUOOO-UHFFFAOYSA-N
XLogP3.16
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-4-methylsulfonyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 83856398
4-ethenyl-2-[(2S)-2-methylazetidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 165396509
6-fluoro-7,9-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinoline
CID 176630668
6,7-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbaldehyde
CID 82450945
3-cyclopropyl-4-methyl-2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 146617411
1-ethenyl-4-methoxybenzene;3-methyl-5,6-dihydro-4H-cyclopenta[c][1,2]oxazole
CID 142903013
ethane;4-ethoxy-2,3-dimethyl-5,6,7,8-tetrahydroquinoline
CID 145341641
4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
CID 23008697
5-chloro-8-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 107628750
2,4-dimethyl-5,6,7,8,9,10,11,12-octahydrocyclodeca[d]pyrimidine
CID 123799232
2,8-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene
CID 15156626
4-chloro-2-methyl-5,6,7,8-tetrahydroquinazoline
CID 19744207

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
The IUPAC name of 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 142222929) is 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine.
What is the SMILES notation for 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
The canonical SMILES for 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine is C=Cc1nc2c(c(C)c1C=C)CCC2.
What is the InChIKey of 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
The InChIKey is YZOXAJYOTKUOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N/c1-4-10-9(3)11-7-6-8-13(11)14-12(10)5-2/h4-5H,1-2,6-8H2,3H3.
What are the key properties of 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 185.27 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 142222929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).