N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine

C15H24N2O — CID 78945255

IUPACN-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine
SMILESCN1CCOC(CNCCCc2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-17-10-11-18-15(13-17)12-16-9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15-16H,5,8-13H2,1H3
InChIKeyNWCMSNWOHCANFG-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.54
Rot. Bonds6

About N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine

N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine (PubChem CID 78945255) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine.

Molecular Properties

Compound NameN-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine
PubChem CID78945255
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine
SMILESCN1CCOC(CNCCCc2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-17-10-11-18-15(13-17)12-16-9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15-16H,5,8-13H2,1H3
InChIKeyNWCMSNWOHCANFG-UHFFFAOYSA-N
XLogP1.54
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-ethylmorpholin-2-yl)methyl]-4-phenylbutan-1-amine
CID 114399789
N-[(4-methylmorpholin-2-yl)methyl]-2-(2-methylphenyl)ethanamine
CID 79749259
N-[(1-methylpyrrolidin-3-yl)methyl]-3-phenylpropan-1-amine
CID 60856584
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylethanesulfonamide
CID 110710282
3-chloro-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 79181889
2-methyl-1-[(4-methylmorpholin-2-yl)methyl]-3-(2-phenylethyl)guanidine
CID 111134903
N-[[(2S)-4-methylmorpholin-2-yl]methyl]-2-thiophen-2-ylethanamine
CID 95303552
1-(4-methylmorpholin-2-yl)-N-phenylmethoxymethanamine
CID 79172103
N-[(4-methylmorpholin-2-yl)methyl]-3-phenylprop-2-yn-1-amine
CID 79071101
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylacetamide
CID 110710224
2-methyl-1-[(4-methylmorpholin-2-yl)methyl]-3-(4-phenylbutan-2-yl)guanidine
CID 111172057
N-[(3-methoxyphenyl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine
CID 95334871

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine?
The IUPAC name of N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine (CID 78945255) is N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine.
What is the SMILES notation for N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine?
The canonical SMILES for N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine is CN1CCOC(CNCCCc2ccccc2)C1.
What is the InChIKey of N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine?
The InChIKey is NWCMSNWOHCANFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17-10-11-18-15(13-17)12-16-9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15-16H,5,8-13H2,1H3.
What are the key properties of N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine?
N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylmorpholin-2-yl)methyl]-3-phenylpropan-1-amine is sourced from PubChem (CID 78945255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).