N-methyl-1-quinolin-5-ylhex-5-en-1-amine

C16H20N2 — CID 105153263

IUPACN-methyl-1-quinolin-5-ylhex-5-en-1-amine
SMILESC=CCCCC(NC)c1cccc2ncccc12
InChIInChI=1S/C16H20N2/c1-3-4-5-10-15(17-2)13-8-6-11-16-14(13)9-7-12-18-16/h3,6-9,11-12,15,17H,1,4-5,10H2,2H3
InChIKeyDFIOIJAUISCGLG-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.85
Rot. Bonds6

About N-methyl-1-quinolin-5-ylhex-5-en-1-amine

N-methyl-1-quinolin-5-ylhex-5-en-1-amine (PubChem CID 105153263) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-1-quinolin-5-ylhex-5-en-1-amine.

Molecular Properties

Compound NameN-methyl-1-quinolin-5-ylhex-5-en-1-amine
PubChem CID105153263
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-methyl-1-quinolin-5-ylhex-5-en-1-amine
SMILESC=CCCCC(NC)c1cccc2ncccc12
InChIInChI=1S/C16H20N2/c1-3-4-5-10-15(17-2)13-8-6-11-16-14(13)9-7-12-18-16/h3,6-9,11-12,15,17H,1,4-5,10H2,2H3
InChIKeyDFIOIJAUISCGLG-UHFFFAOYSA-N
XLogP3.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-1-quinolin-4-yloct-7-en-1-amine
CID 107011594
N-methyl-1-quinolin-5-ylpent-4-yn-1-amine
CID 105149256
1-quinolin-5-ylpent-4-en-1-amine
CID 105153398
2-ethylsulfanyl-N-methyl-1-quinolin-5-ylethanamine
CID 81232043
1-quinolin-4-yloct-7-enylhydrazine
CID 107013009
1-quinolin-5-ylpentylhydrazine
CID 105245773
N-methyl-1-quinolin-4-yloctan-1-amine
CID 105124579
N-ethyl-1-quinolin-5-ylpentan-1-amine
CID 81231643
N-ethyl-1-quinolin-5-ylhexan-1-amine
CID 105020078
1-(2-bromo-3-methylphenyl)-N-methylhex-5-en-1-amine
CID 107985039
1-(3-chloro-2-methylphenyl)-N-methylhex-5-en-1-amine
CID 107102445
2-(4-chlorophenyl)-N-methyl-1-quinolin-5-ylethanamine
CID 81210403

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-quinolin-5-ylhex-5-en-1-amine?
The IUPAC name of N-methyl-1-quinolin-5-ylhex-5-en-1-amine (CID 105153263) is N-methyl-1-quinolin-5-ylhex-5-en-1-amine.
What is the SMILES notation for N-methyl-1-quinolin-5-ylhex-5-en-1-amine?
The canonical SMILES for N-methyl-1-quinolin-5-ylhex-5-en-1-amine is C=CCCCC(NC)c1cccc2ncccc12.
What is the InChIKey of N-methyl-1-quinolin-5-ylhex-5-en-1-amine?
The InChIKey is DFIOIJAUISCGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-3-4-5-10-15(17-2)13-8-6-11-16-14(13)9-7-12-18-16/h3,6-9,11-12,15,17H,1,4-5,10H2,2H3.
What are the key properties of N-methyl-1-quinolin-5-ylhex-5-en-1-amine?
N-methyl-1-quinolin-5-ylhex-5-en-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-quinolin-5-ylhex-5-en-1-amine is sourced from PubChem (CID 105153263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).