N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine

C16H20N2 — CID 66036857

IUPACN-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine
SMILESC=C(CC)CC(NC)c1ccc2ccccc2n1
InChIInChI=1S/C16H20N2/c1-4-12(2)11-16(17-3)15-10-9-13-7-5-6-8-14(13)18-15/h5-10,16-17H,2,4,11H2,1,3H3
InChIKeyKDCGYOHTTVDYBF-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.85
Rot. Bonds5

About N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine

N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine (PubChem CID 66036857) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine
PubChem CID66036857
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine
SMILESC=C(CC)CC(NC)c1ccc2ccccc2n1
InChIInChI=1S/C16H20N2/c1-4-12(2)11-16(17-3)15-10-9-13-7-5-6-8-14(13)18-15/h5-10,16-17H,2,4,11H2,1,3H3
InChIKeyKDCGYOHTTVDYBF-UHFFFAOYSA-N
XLogP3.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-methyl-1-quinolin-2-ylbut-3-yn-1-amine
CID 63222554
1-(2-fluorophenyl)-N-methyl-3-methylidenepentan-1-amine
CID 66037563
N-methyl-3-methylidene-1-(4-methyl-2-pyridinyl)pentan-1-amine
CID 66038280
N-methyl-1-quinolin-2-ylhex-4-yn-1-amine
CID 104805621
2-(2-bromophenyl)-N-methyl-1-quinolin-2-ylethanamine
CID 63222720
N-methyl-1-quinolin-2-yloct-7-en-1-amine
CID 107009092
1-(4-ethylcyclohexyl)-N-methyl-1-quinolin-2-ylmethanamine
CID 64773812
(1S)-1-quinolin-2-ylpropan-1-amine;hydrochloride
CID 171236572
N-(2-phenyl-1-quinolin-2-ylethyl)propan-1-amine
CID 63222770
3-formamido-3-quinolin-2-ylpropanoic acid
CID 64956181
1-quinolin-2-ylbut-3-enylhydrazine
CID 105218718
N-propyl-1-quinolin-2-ylbut-3-yn-1-amine
CID 63222640

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine?
The IUPAC name of N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine (CID 66036857) is N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine.
What is the SMILES notation for N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine?
The canonical SMILES for N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine is C=C(CC)CC(NC)c1ccc2ccccc2n1.
What is the InChIKey of N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine?
The InChIKey is KDCGYOHTTVDYBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-4-12(2)11-16(17-3)15-10-9-13-7-5-6-8-14(13)18-15/h5-10,16-17H,2,4,11H2,1,3H3.
What are the key properties of N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine?
N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-methylidene-1-quinolin-2-ylpentan-1-amine is sourced from PubChem (CID 66036857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).