2-methyl-4-prop-1-enylquinoline

C13H13N — CID 73094462

IUPAC2-methyl-4-prop-1-enylquinoline
SMILESCC=Cc1cc(C)nc2ccccc12
InChIInChI=1S/C13H13N/c1-3-6-11-9-10(2)14-13-8-5-4-7-12(11)13/h3-9H,1-2H3
InChIKeyAELMJYILKUGUHH-UHFFFAOYSA-N
MW183.25 g/mol
LogP3.58
Rot. Bonds1

About 2-methyl-4-prop-1-enylquinoline

2-methyl-4-prop-1-enylquinoline (PubChem CID 73094462) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-methyl-4-prop-1-enylquinoline.

Molecular Properties

Compound Name2-methyl-4-prop-1-enylquinoline
PubChem CID73094462
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name2-methyl-4-prop-1-enylquinoline
SMILESCC=Cc1cc(C)nc2ccccc12
InChIInChI=1S/C13H13N/c1-3-6-11-9-10(2)14-13-8-5-4-7-12(11)13/h3-9H,1-2H3
InChIKeyAELMJYILKUGUHH-UHFFFAOYSA-N
XLogP3.58
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methyl-4-prop-1-enylquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-methylquinolin-4-yl)prop-2-en-1-amine
CID 79234972
tert-butyl (E)-3-(2-methylquinolin-4-yl)prop-2-enoate
CID 11086802
4-(3-chloro-2-methylprop-1-enyl)-2-methylquinoline
CID 79324274
(E)-3-methyl-4-(2-methylquinolin-4-yl)but-3-en-2-ol
CID 103091314
4-[(Z)-prop-1-enyl]quinoline
CID 89064507
2-methylquinolin-4-amine
CID 162035180
3-methyl-1-prop-1-enylisoquinoline
CID 131885557
2-methyl-4-(2-methylbut-2-enyl)quinoline
CID 123480246
(2-methylquinolin-4-yl)methanethiol
CID 79885955
2-(2-methylquinolin-4-yl)acetic acid
CID 79019861
(2-methylquinolin-4-yl)methanamine;dihydrochloride
CID 42946478
N-methyl-N-(2-methylquinolin-4-yl)benzamide
CID 142658948

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-prop-1-enylquinoline?
The IUPAC name of 2-methyl-4-prop-1-enylquinoline (CID 73094462) is 2-methyl-4-prop-1-enylquinoline.
What is the SMILES notation for 2-methyl-4-prop-1-enylquinoline?
The canonical SMILES for 2-methyl-4-prop-1-enylquinoline is CC=Cc1cc(C)nc2ccccc12.
What is the InChIKey of 2-methyl-4-prop-1-enylquinoline?
The InChIKey is AELMJYILKUGUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c1-3-6-11-9-10(2)14-13-8-5-4-7-12(11)13/h3-9H,1-2H3.
What are the key properties of 2-methyl-4-prop-1-enylquinoline?
2-methyl-4-prop-1-enylquinoline has a molecular weight of 183.25 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-prop-1-enylquinoline is sourced from PubChem (CID 73094462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).