2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline

C14H12N2 — CID 140710850

IUPAC2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline
SMILESC=CCc1ccc2ccc3nccc3c2[nH]1
InChIInChI=1S/C14H12N2/c1-2-3-11-6-4-10-5-7-13-12(8-9-15-13)14(10)16-11/h2,4-9,16H,1,3H2
InChIKeyKSFLNFAJQOGOEV-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.44
Rot. Bonds2

About 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline

2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline (PubChem CID 140710850) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline.

Molecular Properties

Compound Name2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline
PubChem CID140710850
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline
SMILESC=CCc1ccc2ccc3nccc3c2[nH]1
InChIInChI=1S/C14H12N2/c1-2-3-11-6-4-10-5-7-13-12(8-9-15-13)14(10)16-11/h2,4-9,16H,1,3H2
InChIKeyKSFLNFAJQOGOEV-UHFFFAOYSA-N
XLogP3.44
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2,3,6,8-tetramethyl-1H-pyrrolo[3,2-h]quinoline
CID 1504463
1H-Pyrrolo[2,3-f]quinoline
CID 135645806
7H-pyrrolo[3,2-f]quinoxaline
CID 135788037
Pyrrolo(2,3-b)carbazole
CID 21888088
2-Methylideneindol-1-ium
CID 59596733
Dihydropyrroloisoquinoline
CID 66919674
5h-Pyrrolo[2,3-f]indole
CID 69450160
Tetrahydroindolo[2,3-d]azepine
CID 87087142
Cyclopentaquinoxaline
CID 87519722
2-methyl-1H-pyrido[2,3-a]carbazole
CID 136493873
4,5-Dihydropyrroloquinoxaline
CID 138756856
4,5-Dihydro-beta-carboline
CID 139024388

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline?
The IUPAC name of 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline (CID 140710850) is 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline.
What is the SMILES notation for 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline?
The canonical SMILES for 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline is C=CCc1ccc2ccc3nccc3c2[nH]1.
What is the InChIKey of 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline?
The InChIKey is KSFLNFAJQOGOEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c1-2-3-11-6-4-10-5-7-13-12(8-9-15-13)14(10)16-11/h2,4-9,16H,1,3H2.
What are the key properties of 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline?
2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline has a molecular weight of 208.26 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enyl-1H-pyrrolo[2,3-h]quinoline is sourced from PubChem (CID 140710850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).