2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine

C16H24N2O — CID 115337256

IUPAC2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine
SMILESCC1OCCC1NCc1ccc2c(c1)CCCN2C
InChIInChI=1S/C16H24N2O/c1-12-15(7-9-19-12)17-11-13-5-6-16-14(10-13)4-3-8-18(16)2/h5-6,10,12,15,17H,3-4,7-9,11H2,1-2H3
InChIKeyRAEMXINPJMEBBT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.34
Rot. Bonds3

About 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine

2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine (PubChem CID 115337256) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine
PubChem CID115337256
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine
SMILESCC1OCCC1NCc1ccc2c(c1)CCCN2C
InChIInChI=1S/C16H24N2O/c1-12-15(7-9-19-12)17-11-13-5-6-16-14(10-13)4-3-8-18(16)2/h5-6,10,12,15,17H,3-4,7-9,11H2,1-2H3
InChIKeyRAEMXINPJMEBBT-UHFFFAOYSA-N
XLogP2.34
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 ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

Analyze 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine with MolForge

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Related Compounds

Dimethyl-(4-{[(tetrahydro-furan-2-ylmethyl)-amino]-methyl}-phenyl)-amine hydrochloride
CID 2960152
2-Cyclohex-1-enyl-4-morpholin-4-ylmethyl-phenylamine
CID 58994529
N-(2,4-Dimethylphenyl)-4-{methyl[(oxolan-2-YL)methyl]amino}piperidine-1-carbothioamide
CID 3395173
3-Methoxy-1,2,3,4-tetrahydroquinoline
CID 19697700
1-(2-Methoxyethyl)-1,2,3,4-tetrahydroquinolin-7-amine
CID 39241439
US11673883, Example 42
CID 132166406
1-(4-(Morpholin-4-yl)phenyl)ethan-1-amine
CID 4912810
N-methyl-4-(morpholin-4-ylmethyl)-2,6-di(propan-2-yl)aniline
CID 44383792
2-ethoxy-N-(2-(1-propyl-1,2,3,4-tetrahydroquinolin-6-yl)ethyl)acetamide
CID 16837176
N1-(2-(1-ethyl-1,2,3,4-tetrahydroquinolin-6-yl)ethyl)-N2-(2-methoxyethyl)oxalamide
CID 16837511
1-[2-(Morpholin-4-yl)phenyl]ethan-1-amine
CID 43188721
2-[(2-fluorophenyl)methyl]-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 156845828

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine?
The IUPAC name of 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine (CID 115337256) is 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine.
What is the SMILES notation for 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine?
The canonical SMILES for 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine is CC1OCCC1NCc1ccc2c(c1)CCCN2C.
What is the InChIKey of 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine?
The InChIKey is RAEMXINPJMEBBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-15(7-9-19-12)17-11-13-5-6-16-14(10-13)4-3-8-18(16)2/h5-6,10,12,15,17H,3-4,7-9,11H2,1-2H3.
What are the key properties of 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine?
2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine has a molecular weight of 260.38 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine is sourced from PubChem (CID 115337256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).