N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine

C17H22N2O — CID 106902040

IUPACN-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
SMILESCc1occc1CN(C)CC1CNc2ccccc2C1
InChIInChI=1S/C17H22N2O/c1-13-16(7-8-20-13)12-19(2)11-14-9-15-5-3-4-6-17(15)18-10-14/h3-8,14,18H,9-12H2,1-2H3
InChIKeyAOBCWQPSFIMZLT-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.30
Rot. Bonds4

About N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine

N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine (PubChem CID 106902040) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
PubChem CID106902040
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
SMILESCc1occc1CN(C)CC1CNc2ccccc2C1
InChIInChI=1S/C17H22N2O/c1-13-16(7-8-20-13)12-19(2)11-14-9-15-5-3-4-6-17(15)18-10-14/h3-8,14,18H,9-12H2,1-2H3
InChIKeyAOBCWQPSFIMZLT-UHFFFAOYSA-N
XLogP3.30
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine with MolForge

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Related Compounds

N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
CID 106902024
N-[(2-chlorophenyl)methyl]-N-methyl-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
CID 106902030
N-methyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)propan-2-amine
CID 106901949
3,3,3-trifluoro-N-methyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)propan-1-amine
CID 106902239
N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)butan-1-amine
CID 106901978
N-methyl-1-(oxan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)methanamine
CID 106902048
N-methyl-2-pyrrolidin-1-yl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)ethanamine
CID 106902191
N-butyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)butan-1-amine
CID 106901965
N,3-dimethyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)cyclohexan-1-amine
CID 106902062
N,N-dimethyl-N'-(2-methylpropyl)-N'-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)ethane-1,2-diamine
CID 106902107
N-methyl-4-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]oxolan-3-amine
CID 66245971
3-fluoro-N-methyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)aniline
CID 106902144

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
The IUPAC name of N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine (CID 106902040) is N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine.
What is the SMILES notation for N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
The canonical SMILES for N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine is Cc1occc1CN(C)CC1CNc2ccccc2C1.
What is the InChIKey of N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
The InChIKey is AOBCWQPSFIMZLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-13-16(7-8-20-13)12-19(2)11-14-9-15-5-3-4-6-17(15)18-10-14/h3-8,14,18H,9-12H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine has a molecular weight of 270.38 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylfuran-3-yl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine is sourced from PubChem (CID 106902040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).