1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine

C16H16N2O — CID 23936129

IUPAC1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine
SMILESCN(Cc1cnc2ccccc2c1)Cc1ccco1
InChIInChI=1S/C16H16N2O/c1-18(12-15-6-4-8-19-15)11-13-9-14-5-2-3-7-16(14)17-10-13/h2-10H,11-12H2,1H3
InChIKeyJDDCBTXNPXFZEX-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.46
Rot. Bonds4

About 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine

1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine (PubChem CID 23936129) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine
PubChem CID23936129
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine
SMILESCN(Cc1cnc2ccccc2c1)Cc1ccco1
InChIInChI=1S/C16H16N2O/c1-18(12-15-6-4-8-19-15)11-13-9-14-5-2-3-7-16(14)17-10-13/h2-10H,11-12H2,1H3
InChIKeyJDDCBTXNPXFZEX-UHFFFAOYSA-N
XLogP3.46
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
N-methyl-N-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]-1-quinolin-3-ylmethanamine
CID 91839982
2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol
CID 113345069
N-ethyl-4-[[furan-2-ylmethyl(methyl)amino]methyl]pyridin-2-amine
CID 62471347
N-[(2-chloro-1,3-thiazol-5-yl)methyl]-1-(furan-2-yl)-N-methylmethanamine
CID 79764459
2-[furan-2-ylmethyl(methyl)amino]quinoline-3-carbaldehyde
CID 43527026
2-chloro-5-[[furan-2-ylmethyl(methyl)amino]methyl]aniline
CID 43526580
N,1-dimethyl-N-(quinolin-3-ylmethyl)pyrazol-4-amine
CID 100703434
6-[[furan-2-ylmethyl(methyl)amino]methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 63220353
1-(3-bromo-4-fluorophenyl)-N-(furan-2-ylmethyl)-N-methylmethanamine
CID 61036810
3-(2-methylpropyl)quinoline
CID 12072851
N,4-dimethyl-N-(quinolin-3-ylmethyl)benzenesulfonamide
CID 110733912

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine?
The IUPAC name of 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine (CID 23936129) is 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine.
What is the SMILES notation for 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine?
The canonical SMILES for 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine is CN(Cc1cnc2ccccc2c1)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine?
The InChIKey is JDDCBTXNPXFZEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-18(12-15-6-4-8-19-15)11-13-9-14-5-2-3-7-16(14)17-10-13/h2-10H,11-12H2,1H3.
What are the key properties of 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine?
1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine has a molecular weight of 252.32 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine is sourced from PubChem (CID 23936129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).