1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine

C16H18N2O — CID 102653080

IUPAC1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
SMILESCNC(C1=CCCO1)c1cc(C)nc2ccccc12
InChIInChI=1S/C16H18N2O/c1-11-10-13(12-6-3-4-7-14(12)18-11)16(17-2)15-8-5-9-19-15/h3-4,6-8,10,16-17H,5,9H2,1-2H3
InChIKeyYWYROGPDQTVLMS-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.11
Rot. Bonds3

About 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine

1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine (PubChem CID 102653080) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
PubChem CID102653080
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
SMILESCNC(C1=CCCO1)c1cc(C)nc2ccccc12
InChIInChI=1S/C16H18N2O/c1-11-10-13(12-6-3-4-7-14(12)18-11)16(17-2)15-8-5-9-19-15/h3-4,6-8,10,16-17H,5,9H2,1-2H3
InChIKeyYWYROGPDQTVLMS-UHFFFAOYSA-N
XLogP3.11
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
CID 105076264
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107357474
1-(5-chlorothiophen-2-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
CID 105173392
N-methyl-1-(1-methylpyrazol-3-yl)-1-(2-methylquinolin-4-yl)methanamine
CID 103135765
N-methyl-3-(2-methylquinolin-4-yl)butan-2-amine
CID 63199652
N-methyl-1-(2-methylquinolin-4-yl)butan-1-amine
CID 105080240
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 102652299
1-(3,4-dihydro-2H-pyran-6-yl)-1-isoquinolin-1-yl-N-methylmethanamine
CID 102647455
[cyclohepten-1-yl-(2-methylquinolin-4-yl)methyl]hydrazine
CID 106650256
2-cyclobutyl-N-methyl-1-(2-methylquinolin-4-yl)ethanamine
CID 105151599
1-[2-(difluoromethoxy)phenyl]-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
CID 102653477
1-(2,3-dihydrofuran-5-yl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
CID 102653596

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine (CID 102653080) is 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine is CNC(C1=CCCO1)c1cc(C)nc2ccccc12.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine?
The InChIKey is YWYROGPDQTVLMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11-10-13(12-6-3-4-7-14(12)18-11)16(17-2)15-8-5-9-19-15/h3-4,6-8,10,16-17H,5,9H2,1-2H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine?
1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine has a molecular weight of 254.33 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine is sourced from PubChem (CID 102653080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).