ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine

C17H30N2O — CID 143114202

IUPACethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine
SMILESCC.CCN(C)C(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C15H24N2O.C2H6/c1-3-16(2)15(14-7-5-4-6-8-14)13-17-9-11-18-12-10-17;1-2/h4-8,15H,3,9-13H2,1-2H3;1-2H3
InChIKeyDHGNGQPYEOELOD-UHFFFAOYSA-N
MW278.44 g/mol
LogP3.04
Rot. Bonds5

About ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine

ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine (PubChem CID 143114202) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine.

Molecular Properties

Compound Nameethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine
PubChem CID143114202
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Nameethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine
SMILESCC.CCN(C)C(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C15H24N2O.C2H6/c1-3-16(2)15(14-7-5-4-6-8-14)13-17-9-11-18-12-10-17;1-2/h4-8,15H,3,9-13H2,1-2H3;1-2H3
InChIKeyDHGNGQPYEOELOD-UHFFFAOYSA-N
XLogP3.04
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-2-morpholin-4-yl-1-phenylethanamine
CID 6927910
4-[(2S)-2-phenylpropyl]morpholine
CID 757569
tert-butyl-(2-morpholin-4-yl-1-phenylethyl)carbamic acid
CID 175111015
4-[(2S)-2-chloro-2-phenylethyl]morpholine
CID 92778596
4-[(2R)-2-fluoro-2-phenylethyl]morpholine
CID 134934166
N-benzhydryl-N-methyl-2-morpholin-4-ylethanamine;hydrochloride
CID 54600904
N,N-dimethyl-2-(4-methylpiperazin-1-yl)-1-phenylethanamine
CID 143114177
(2R)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322241
(2S)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322239
N-cyano-2-(2-methylphenyl)-N-(2-morpholin-4-yl-1-phenylethyl)ethanimidamide
CID 11682048
2,5-bis(morpholin-4-ylmethyl)-1,6-diphenylhexane-1,6-diol
CID 56688049
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine?
The IUPAC name of ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine (CID 143114202) is ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine.
What is the SMILES notation for ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine?
The canonical SMILES for ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine is CC.CCN(C)C(CN1CCOCC1)c1ccccc1.
What is the InChIKey of ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine?
The InChIKey is DHGNGQPYEOELOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.C2H6/c1-3-16(2)15(14-7-5-4-6-8-14)13-17-9-11-18-12-10-17;1-2/h4-8,15H,3,9-13H2,1-2H3;1-2H3.
What are the key properties of ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine?
ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine has a molecular weight of 278.44 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-N-methyl-2-morpholin-4-yl-1-phenylethanamine is sourced from PubChem (CID 143114202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).