1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine

C18H20N2O — CID 78943029

IUPAC1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
SMILESCc1cc(CNC(C)Cc2ccco2)c2ccccc2n1
InChIInChI=1S/C18H20N2O/c1-13(11-16-6-5-9-21-16)19-12-15-10-14(2)20-18-8-4-3-7-17(15)18/h3-10,13,19H,11-12H2,1-2H3
InChIKeyMMDNJBMRZVDFTE-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.86
Rot. Bonds5

About 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine

1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine (PubChem CID 78943029) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
PubChem CID78943029
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
SMILESCc1cc(CNC(C)Cc2ccco2)c2ccccc2n1
InChIInChI=1S/C18H20N2O/c1-13(11-16-6-5-9-21-16)19-12-15-10-14(2)20-18-8-4-3-7-17(15)18/h3-10,13,19H,11-12H2,1-2H3
InChIKeyMMDNJBMRZVDFTE-UHFFFAOYSA-N
XLogP3.86
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-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

5-methyl-N-[(2-methylquinolin-4-yl)methyl]hexan-2-amine
CID 78942763
2-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]ethanamine
CID 78942785
3-[(2-methylquinolin-4-yl)methylamino]butan-1-ol
CID 78998387
1-(furan-2-yl)-N-(quinolin-2-ylmethyl)propan-2-amine
CID 61043173
N-[(2-methylquinolin-4-yl)methyl]-1-pyridin-2-ylethanamine
CID 78943042
N-[(2-methylquinolin-4-yl)methyl]-1-pyrazol-1-ylpropan-2-amine
CID 78943040
2-methyl-N-[(2-methylquinolin-4-yl)methyl]pentan-3-amine
CID 78942769
1-imidazol-1-yl-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
CID 78943044
1-(furan-2-yl)-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]propan-2-amine
CID 62475299
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-(furan-2-yl)propan-2-amine
CID 64540987
(2S)-1-(furan-2-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propan-2-amine
CID 93264764
N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine
CID 60716310

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine?
The IUPAC name of 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine (CID 78943029) is 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine?
The canonical SMILES for 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine is Cc1cc(CNC(C)Cc2ccco2)c2ccccc2n1.
What is the InChIKey of 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine?
The InChIKey is MMDNJBMRZVDFTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-13(11-16-6-5-9-21-16)19-12-15-10-14(2)20-18-8-4-3-7-17(15)18/h3-10,13,19H,11-12H2,1-2H3.
What are the key properties of 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine?
1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine has a molecular weight of 280.37 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine is sourced from PubChem (CID 78943029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).