1-(4-methylquinolin-2-yl)pent-4-en-1-amine

C15H18N2 — CID 114755015

IUPAC1-(4-methylquinolin-2-yl)pent-4-en-1-amine
SMILESC=CCCC(N)c1cc(C)c2ccccc2n1
InChIInChI=1S/C15H18N2/c1-3-4-8-13(16)15-10-11(2)12-7-5-6-9-14(12)17-15/h3,5-7,9-10,13H,1,4,8,16H2,2H3
InChIKeyRMUFTWBXXNPCBE-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.51
Rot. Bonds4

About 1-(4-methylquinolin-2-yl)pent-4-en-1-amine

1-(4-methylquinolin-2-yl)pent-4-en-1-amine (PubChem CID 114755015) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-(4-methylquinolin-2-yl)pent-4-en-1-amine.

Molecular Properties

Compound Name1-(4-methylquinolin-2-yl)pent-4-en-1-amine
PubChem CID114755015
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name1-(4-methylquinolin-2-yl)pent-4-en-1-amine
SMILESC=CCCC(N)c1cc(C)c2ccccc2n1
InChIInChI=1S/C15H18N2/c1-3-4-8-13(16)15-10-11(2)12-7-5-6-9-14(12)17-15/h3,5-7,9-10,13H,1,4,8,16H2,2H3
InChIKeyRMUFTWBXXNPCBE-UHFFFAOYSA-N
XLogP3.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-methylquinolin-2-yl)pent-3-yn-1-amine
CID 114755048
1-(4-methylquinolin-2-yl)-N-propylhex-5-en-1-amine
CID 114755324
(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
CID 104969389
(4-chlorophenyl)-(4-methylquinolin-2-yl)methanamine
CID 114754979
1-(4-methoxyquinolin-2-yl)propane-1,3-diamine
CID 22640741
1-(4-methylquinolin-2-yl)pent-4-en-1-one
CID 114754704
(1R)-1-(2-methylphenyl)pent-4-en-1-amine;hydrochloride
CID 171209860
2-(1-ethylimidazol-2-yl)-1-(4-methylquinolin-2-yl)ethanamine
CID 114755024
(1R)-1-(6-bromo-2-pyridinyl)pent-4-en-1-amine;hydrochloride
CID 171203412
[4-methyl-1-(4-methylquinolin-2-yl)pent-4-enyl]hydrazine
CID 105279669
(1R)-1-(2-methyl-1H-indol-3-yl)pent-4-en-1-amine
CID 171206860
(1R)-1-naphthalen-1-ylpent-4-en-1-amine;hydrochloride
CID 171212052

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylquinolin-2-yl)pent-4-en-1-amine?
The IUPAC name of 1-(4-methylquinolin-2-yl)pent-4-en-1-amine (CID 114755015) is 1-(4-methylquinolin-2-yl)pent-4-en-1-amine.
What is the SMILES notation for 1-(4-methylquinolin-2-yl)pent-4-en-1-amine?
The canonical SMILES for 1-(4-methylquinolin-2-yl)pent-4-en-1-amine is C=CCCC(N)c1cc(C)c2ccccc2n1.
What is the InChIKey of 1-(4-methylquinolin-2-yl)pent-4-en-1-amine?
The InChIKey is RMUFTWBXXNPCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-3-4-8-13(16)15-10-11(2)12-7-5-6-9-14(12)17-15/h3,5-7,9-10,13H,1,4,8,16H2,2H3.
What are the key properties of 1-(4-methylquinolin-2-yl)pent-4-en-1-amine?
1-(4-methylquinolin-2-yl)pent-4-en-1-amine has a molecular weight of 226.32 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylquinolin-2-yl)pent-4-en-1-amine is sourced from PubChem (CID 114755015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).