4-(3-methylidenepent-4-enyl)quinoline

C15H15N — CID 87131912

IUPAC4-(3-methylidenepent-4-enyl)quinoline
SMILESC=CC(=C)CCc1ccnc2ccccc12
InChIInChI=1S/C15H15N/c1-3-12(2)8-9-13-10-11-16-15-7-5-4-6-14(13)15/h3-7,10-11H,1-2,8-9H2
InChIKeyGAXHNXAPDJFRMG-UHFFFAOYSA-N
MW209.29 g/mol
LogP3.91
Rot. Bonds4

About 4-(3-methylidenepent-4-enyl)quinoline

4-(3-methylidenepent-4-enyl)quinoline (PubChem CID 87131912) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-(3-methylidenepent-4-enyl)quinoline.

Molecular Properties

Compound Name4-(3-methylidenepent-4-enyl)quinoline
PubChem CID87131912
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC Name4-(3-methylidenepent-4-enyl)quinoline
SMILESC=CC(=C)CCc1ccnc2ccccc12
InChIInChI=1S/C15H15N/c1-3-12(2)8-9-13-10-11-16-15-7-5-4-6-14(13)15/h3-7,10-11H,1-2,8-9H2
InChIKeyGAXHNXAPDJFRMG-UHFFFAOYSA-N
XLogP3.91
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-quinolin-4-ylpropan-1-ol
CID 21218471
N-(quinolin-4-ylmethyl)ethenamine
CID 166934821
3-(3-quinolin-4-ylpropanoylamino)propanoic acid
CID 119351290
4-(2-pyridin-4-ylethyl)quinoline
CID 70184039
4-quinolin-4-ylbutan-1-amine
CID 10559963
5-quinolin-4-ylpentan-1-amine
CID 71089574
(2S)-2-(3-quinolin-4-ylpropanoylamino)propanoic acid
CID 119943149
6-quinolin-4-ylhexan-2-ol
CID 90935921
3-quinolin-5-ylpropanoic acid
CID 81224223
(2-ethenylphenyl)methylidene-(quinolin-4-ylmethyl)azanium
CID 143201385
4-(quinolin-4-ylmethyl)phenol
CID 83128983
N-(quinolin-4-ylmethyl)ethanamine
CID 58978367

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylidenepent-4-enyl)quinoline?
The IUPAC name of 4-(3-methylidenepent-4-enyl)quinoline (CID 87131912) is 4-(3-methylidenepent-4-enyl)quinoline.
What is the SMILES notation for 4-(3-methylidenepent-4-enyl)quinoline?
The canonical SMILES for 4-(3-methylidenepent-4-enyl)quinoline is C=CC(=C)CCc1ccnc2ccccc12.
What is the InChIKey of 4-(3-methylidenepent-4-enyl)quinoline?
The InChIKey is GAXHNXAPDJFRMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N/c1-3-12(2)8-9-13-10-11-16-15-7-5-4-6-14(13)15/h3-7,10-11H,1-2,8-9H2.
What are the key properties of 4-(3-methylidenepent-4-enyl)quinoline?
4-(3-methylidenepent-4-enyl)quinoline has a molecular weight of 209.29 g/mol, XLogP of 3.91, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylidenepent-4-enyl)quinoline is sourced from PubChem (CID 87131912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).