N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine

C14H17N3 — CID 166969759

IUPACN-methyl-3-(methylideneamino)-N-propylquinolin-4-amine
SMILESC=Nc1cnc2ccccc2c1N(C)CCC
InChIInChI=1S/C14H17N3/c1-4-9-17(3)14-11-7-5-6-8-12(11)16-10-13(14)15-2/h5-8,10H,2,4,9H2,1,3H3
InChIKeyVTNGLIQRYPCYHX-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.41
Rot. Bonds4

About N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine

N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine (PubChem CID 166969759) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine.

Molecular Properties

Compound NameN-methyl-3-(methylideneamino)-N-propylquinolin-4-amine
PubChem CID166969759
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-methyl-3-(methylideneamino)-N-propylquinolin-4-amine
SMILESC=Nc1cnc2ccccc2c1N(C)CCC
InChIInChI=1S/C14H17N3/c1-4-9-17(3)14-11-7-5-6-8-12(11)16-10-13(14)15-2/h5-8,10H,2,4,9H2,1,3H3
InChIKeyVTNGLIQRYPCYHX-UHFFFAOYSA-N
XLogP3.41
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine 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-(aminomethyl)-N-methyl-N-pentylquinolin-4-amine
CID 43669373
N-[4-[(Z)-prop-1-enyl]quinolin-3-yl]methanimine
CID 131966589
4-[2-(dimethylamino)ethyl-methylamino]quinoline-3-carbonitrile
CID 63693524
4-N-(2-methoxyethyl)-4-N-methylquinoline-3,4-diamine
CID 113359409
4-[2-(dimethylamino)ethyl-methylamino]-N'-hydroxyquinoline-3-carboximidamide
CID 77017337
3-[(3-aminoquinolin-4-yl)-methylamino]propanenitrile
CID 103962717
4-[ethyl(methyl)amino]quinoline-3-carboxylic acid
CID 61340798
4-[methyl(pentyl)amino]quinoline-3-carboximidamide
CID 43669819
3-[[3-(aminomethyl)quinolin-4-yl]-methylamino]propan-1-ol
CID 114230085
3-bromo-N,N-dimethylquinolin-4-amine
CID 119086885
4-[5-hydroxypentyl(methyl)amino]quinoline-3-carboxylic acid
CID 107200323
4-[3-aminopropyl(methyl)amino]quinoline-3-carboxamide
CID 115319371

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine?
The IUPAC name of N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine (CID 166969759) is N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine.
What is the SMILES notation for N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine?
The canonical SMILES for N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine is C=Nc1cnc2ccccc2c1N(C)CCC.
What is the InChIKey of N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine?
The InChIKey is VTNGLIQRYPCYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-4-9-17(3)14-11-7-5-6-8-12(11)16-10-13(14)15-2/h5-8,10H,2,4,9H2,1,3H3.
What are the key properties of N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine?
N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine has a molecular weight of 227.31 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(methylideneamino)-N-propylquinolin-4-amine is sourced from PubChem (CID 166969759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).