N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine

C13H20N2O — CID 82616430

IUPACN-methyl-2-(4-morpholin-4-ylphenyl)ethanamine
SMILESCNCCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C13H20N2O/c1-14-7-6-12-2-4-13(5-3-12)15-8-10-16-11-9-15/h2-5,14H,6-11H2,1H3
InChIKeyWHCVKQNFKRKSHJ-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.29
Rot. Bonds4

About N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine

N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine (PubChem CID 82616430) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(4-morpholin-4-ylphenyl)ethanamine
PubChem CID82616430
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-methyl-2-(4-morpholin-4-ylphenyl)ethanamine
SMILESCNCCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C13H20N2O/c1-14-7-6-12-2-4-13(5-3-12)15-8-10-16-11-9-15/h2-5,14H,6-11H2,1H3
InChIKeyWHCVKQNFKRKSHJ-UHFFFAOYSA-N
XLogP1.29
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

2-(4-morpholin-4-ylphenyl)ethanamine
CID 23009596
1,1-dimethyl-3-[2-(4-morpholin-4-ylphenyl)ethyl]urea
CID 110405022
4-(4-ethylphenyl)morpholine
CID 20576442
2-[4-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)phenyl]ethanamine
CID 170868542
N-methyl-4-(4-pyrrolidin-1-ylphenyl)butan-1-amine
CID 112518014
2-(4-methoxyphenyl)-N-[2-(4-morpholin-4-ylphenyl)ethyl]acetamide
CID 16889551
2-(4-methoxyphenyl)-N-[2-(4-morpholin-4-ylphenyl)ethyl]ethanesulfonamide
CID 16890665
4-(4-morpholin-4-ylphenyl)butan-2-amine
CID 23009589
4-(4-benzylphenyl)morpholine
CID 11514364
4-morpholin-4-yl-N-(2-pyridin-4-ylethyl)aniline
CID 63180016
1-methyl-4-[4-[2-(methylamino)ethyl]phenyl]piperazin-2-one
CID 117371591
(4-morpholin-4-ylphenyl)methanol
CID 2776456

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine?
The IUPAC name of N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine (CID 82616430) is N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine.
What is the SMILES notation for N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine?
The canonical SMILES for N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine is CNCCc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine?
The InChIKey is WHCVKQNFKRKSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-14-7-6-12-2-4-13(5-3-12)15-8-10-16-11-9-15/h2-5,14H,6-11H2,1H3.
What are the key properties of N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine?
N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine has a molecular weight of 220.32 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine is sourced from PubChem (CID 82616430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).