N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine

C13H20N2O — CID 116956481

IUPACN-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine
SMILESCNC(c1cccc(C)c1)C1CNCCO1
InChIInChI=1S/C13H20N2O/c1-10-4-3-5-11(8-10)13(14-2)12-9-15-6-7-16-12/h3-5,8,12-15H,6-7,9H2,1-2H3
InChIKeyWRZQPUNRIFPOFN-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.24
Rot. Bonds3

About N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine

N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine (PubChem CID 116956481) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine
PubChem CID116956481
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine
SMILESCNC(c1cccc(C)c1)C1CNCCO1
InChIInChI=1S/C13H20N2O/c1-10-4-3-5-11(8-10)13(14-2)12-9-15-6-7-16-12/h3-5,8,12-15H,6-7,9H2,1-2H3
InChIKeyWRZQPUNRIFPOFN-UHFFFAOYSA-N
XLogP1.24
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methoxy-3,5-dimethylphenyl)-N-methyl-1-morpholin-2-ylmethanamine
CID 116956491
N-methyl-1-(2-methyl-5-propan-2-ylphenyl)-1-morpholin-2-ylmethanamine
CID 116956461
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-morpholin-2-ylmethanamine
CID 116956467
(2S)-2-[(2-chloro-4-fluorophenoxy)-(3-methylphenyl)methyl]morpholine
CID 68596273
(2S)-2-[(S)-(2-chloro-5-fluorophenoxy)-(3-methylphenyl)methyl]morpholine;hydrochloride
CID 68597724
N-methyl-1-(3-methylphenyl)-1-pyrrolidin-2-ylmethanamine
CID 116950968
(2S)-2-[(S)-(4-fluoro-2-methoxyphenoxy)-(3-methylphenyl)methyl]morpholine;hydrochloride
CID 68598787
N-methyl-1-(2-methylcyclopropyl)-1-(3-methylphenyl)methanamine
CID 65422773
(2R)-2-(3-methylphenyl)morpholine
CID 42182782
1-(3-bicyclo[3.1.0]hexanyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115789805
1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
CID 65399402
1-cyclohexyl-N-methyl-1-(3-methylphenyl)methanamine
CID 60818000

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine?
The IUPAC name of N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine (CID 116956481) is N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine.
What is the SMILES notation for N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine?
The canonical SMILES for N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine is CNC(c1cccc(C)c1)C1CNCCO1.
What is the InChIKey of N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine?
The InChIKey is WRZQPUNRIFPOFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-4-3-5-11(8-10)13(14-2)12-9-15-6-7-16-12/h3-5,8,12-15H,6-7,9H2,1-2H3.
What are the key properties of N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine?
N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine has a molecular weight of 220.32 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylphenyl)-1-morpholin-2-ylmethanamine is sourced from PubChem (CID 116956481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).