N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline

C18H22N2O — CID 91471517

IUPACN-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline
SMILESCN(c1ccccc1)C(c1ccccc1)N1CCOCC1
InChIInChI=1S/C18H22N2O/c1-19(17-10-6-3-7-11-17)18(16-8-4-2-5-9-16)20-12-14-21-15-13-20/h2-11,18H,12-15H2,1H3
InChIKeyJNRFNLFKXGIKEM-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.15
Rot. Bonds4

About N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline

N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline (PubChem CID 91471517) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline.

Molecular Properties

Compound NameN-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline
PubChem CID91471517
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline
SMILESCN(c1ccccc1)C(c1ccccc1)N1CCOCC1
InChIInChI=1S/C18H22N2O/c1-19(17-10-6-3-7-11-17)18(16-8-4-2-5-9-16)20-12-14-21-15-13-20/h2-11,18H,12-15H2,1H3
InChIKeyJNRFNLFKXGIKEM-UHFFFAOYSA-N
XLogP3.15
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7,16-bis[(1R)-1-phenylethyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
CID 12990897
4-(1-phenylethyl)morpholine;hydrochloride
CID 3057369
4-[(S)-(3-methylphenyl)-phenylmethyl]morpholine
CID 71608225
4-(1-phenylbut-2-ynyl)morpholine
CID 3787055
2-[(S)-morpholin-4-yl(phenyl)methyl]phenol
CID 36690968
2-morpholin-4-yl-2-phenylacetaldehyde;hydrochloride
CID 87063992
(3S,4S)-3,4-dimorpholin-4-yl-4-phenylbutan-2-one
CID 680065
4-[(4-methylcyclohexyl)-phenylmethyl]morpholine
CID 91473970
4-[(E)-4-phenylbut-3-en-2-yl]morpholine
CID 101488129
N-benzhydryl-N-methyl-2-morpholin-4-ylethanamine;hydrochloride
CID 54600904
N-ethyl-2-morpholin-4-yl-2-phenylethanamine;molecular hydrogen
CID 144767437
(1R,2R)-1-benzhydryloxy-2-morpholin-4-ylpropan-1-ol
CID 101454375

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline?
The IUPAC name of N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline (CID 91471517) is N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline.
What is the SMILES notation for N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline?
The canonical SMILES for N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline is CN(c1ccccc1)C(c1ccccc1)N1CCOCC1.
What is the InChIKey of N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline?
The InChIKey is JNRFNLFKXGIKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-19(17-10-6-3-7-11-17)18(16-8-4-2-5-9-16)20-12-14-21-15-13-20/h2-11,18H,12-15H2,1H3.
What are the key properties of N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline?
N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline has a molecular weight of 282.39 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[morpholin-4-yl(phenyl)methyl]aniline is sourced from PubChem (CID 91471517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).