N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine

C16H24N2O — CID 63713437

IUPACN-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine
SMILESCN(CC1CCCOC1)C1CNc2ccccc2C1
InChIInChI=1S/C16H24N2O/c1-18(11-13-5-4-8-19-12-13)15-9-14-6-2-3-7-16(14)17-10-15/h2-3,6-7,13,15,17H,4-5,8-12H2,1H3
InChIKeyUQLRMNWLAKBMTQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.38
Rot. Bonds3

About N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine

N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine (PubChem CID 63713437) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine.

Molecular Properties

Compound NameN-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine
PubChem CID63713437
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine
SMILESCN(CC1CCCOC1)C1CNc2ccccc2C1
InChIInChI=1S/C16H24N2O/c1-18(11-13-5-4-8-19-12-13)15-9-14-6-2-3-7-16(14)17-10-15/h2-3,6-7,13,15,17H,4-5,8-12H2,1H3
InChIKeyUQLRMNWLAKBMTQ-UHFFFAOYSA-N
XLogP2.38
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N,N'-trimethyl-N'-(1,2,3,4-tetrahydroquinolin-3-yl)ethane-1,2-diamine
CID 63694889
N,3-dimethyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)cyclohexan-1-amine
CID 106902062
2-[methyl(oxan-3-ylmethyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 63713346
N-ethyl-N-(oxolan-3-ylmethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901310
N-methyl-1-(oxan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)methanamine
CID 106902048
N-methyl-N-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 82739395
(2S)-N-(oxan-3-ylmethyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61163649
N-methyl-1-(oxan-3-yl)-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 63705707
2-[methyl(1,2,3,4-tetrahydroquinolin-3-yl)amino]-1-pyrrolidin-1-ylethanone
CID 61442426
N-methyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)propan-2-amine
CID 106901949
N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
CID 175701227
4-[methyl(oxan-3-ylmethyl)amino]-1-phenylbutan-1-one
CID 63712078

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine?
The IUPAC name of N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine (CID 63713437) is N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine.
What is the SMILES notation for N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine?
The canonical SMILES for N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine is CN(CC1CCCOC1)C1CNc2ccccc2C1.
What is the InChIKey of N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine?
The InChIKey is UQLRMNWLAKBMTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-18(11-13-5-4-8-19-12-13)15-9-14-6-2-3-7-16(14)17-10-15/h2-3,6-7,13,15,17H,4-5,8-12H2,1H3.
What are the key properties of N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine?
N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine has a molecular weight of 260.38 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-amine is sourced from PubChem (CID 63713437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).