(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine

C15H24N2O — CID 79165339

IUPAC(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine
SMILESCCN1CCOC(CN[C@@H](C)c2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-3-17-9-10-18-15(12-17)11-16-13(2)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12H2,1-2H3/t13-,15?/m0/s1
InChIKeyNDKHNGAJTAXILL-CFMCSPIPSA-N
MW248.37 g/mol
LogP2.06
Rot. Bonds5

About (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine

(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine (PubChem CID 79165339) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine.

Molecular Properties

Compound Name(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine
PubChem CID79165339
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine
SMILESCCN1CCOC(CN[C@@H](C)c2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-3-17-9-10-18-15(12-17)11-16-13(2)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12H2,1-2H3/t13-,15?/m0/s1
InChIKeyNDKHNGAJTAXILL-CFMCSPIPSA-N
XLogP2.06
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-(4-fluorophenyl)ethanamine
CID 81347515
4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol
CID 114399621
N-[(4-ethylmorpholin-2-yl)methyl]-1-(3-fluorophenyl)ethanamine
CID 78946838
1-(4-ethoxyphenyl)-N-[(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 115900054
N-[(4-ethylmorpholin-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 79164854
N-[(4-ethylmorpholin-2-yl)methyl]-2-methoxy-1-phenylethanamine
CID 103913578
N-[(4-ethylmorpholin-2-yl)methyl]-1-(1-methylpyrazol-4-yl)ethanamine
CID 113353975
N-[(4-ethylmorpholin-2-yl)methyl]-3-methyl-2-phenylbutan-1-amine
CID 107876440
N-[(4-ethylmorpholin-2-yl)methyl]-1,1-dithiophen-2-ylmethanamine
CID 114399605
1-(3-bromo-4-methoxyphenyl)-N-[(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 115899774
N-[(4-ethylmorpholin-2-yl)methyl]-1-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115899761
N-[(4-ethylmorpholin-2-yl)methyl]-1-(1-methylimidazol-2-yl)ethanamine
CID 113353970

Frequently Asked Questions

What is the IUPAC name of (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine?
The IUPAC name of (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine (CID 79165339) is (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine.
What is the SMILES notation for (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine?
The canonical SMILES for (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine is CCN1CCOC(CN[C@@H](C)c2ccccc2)C1.
What is the InChIKey of (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine?
The InChIKey is NDKHNGAJTAXILL-CFMCSPIPSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-17-9-10-18-15(12-17)11-16-13(2)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12H2,1-2H3/t13-,15?/m0/s1.
What are the key properties of (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine?
(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine has a molecular weight of 248.37 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine is sourced from PubChem (CID 79165339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).