2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol

C21H28N2O2 — CID 146081346

IUPAC2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol
SMILESCc1ccccc1C(CN1CCOCC1)NCC(O)c1ccccc1
InChIInChI=1S/C21H28N2O2/c1-17-7-5-6-10-19(17)20(16-23-11-13-25-14-12-23)22-15-21(24)18-8-3-2-4-9-18/h2-10,20-22,24H,11-16H2,1H3
InChIKeyCPNGSAISNBKMKY-UHFFFAOYSA-N
MW340.47 g/mol
LogP2.69
Rot. Bonds7

About 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol

2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol (PubChem CID 146081346) has the molecular formula C21H28N2O2 and a molecular weight of 340.47 g/mol. Its IUPAC name is 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol
PubChem CID146081346
Molecular FormulaC21H28N2O2
Molecular Weight340.47 g/mol
Exact Mass340.22
IUPAC Name2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol
SMILESCc1ccccc1C(CN1CCOCC1)NCC(O)c1ccccc1
InChIInChI=1S/C21H28N2O2/c1-17-7-5-6-10-19(17)20(16-23-11-13-25-14-12-23)22-15-21(24)18-8-3-2-4-9-18/h2-10,20-22,24H,11-16H2,1H3
InChIKeyCPNGSAISNBKMKY-UHFFFAOYSA-N
XLogP2.69
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol with MolForge

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Related Compounds

(1S)-1-(2-methylphenyl)-2-morpholin-4-yl-N-[[(2R)-oxolan-2-yl]methyl]ethanamine
CID 99854285
(1R)-1-(2-methylphenyl)-N-[(1-methylpiperidin-4-yl)methyl]-2-morpholin-4-ylethanamine
CID 99854313
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
1-(2-methylphenyl)-3-[(1S)-2-morpholin-4-yl-1-phenylethyl]thiourea
CID 8564027
(1S)-N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(2-methylphenyl)-2-morpholin-4-ylethanamine
CID 99782963
(2S)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322239
(2R)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322241
(1R)-2-(2-morpholin-4-ylethylamino)-1-phenylethanol
CID 39353337
1-(2,3-dimethylphenyl)-3-[(1R)-2-morpholin-4-yl-1-phenylethyl]thiourea
CID 8564078
2-(2,3-dimethylphenyl)-2-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]acetic acid
CID 166254157
1-(3-bromophenyl)-2-(1-morpholin-4-ylpropan-2-ylamino)ethanol
CID 60969893
N-(2-morpholin-4-ylethyl)-1-phenyl-2-piperidin-1-ylethanamine
CID 51000971

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol?
The IUPAC name of 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol (CID 146081346) is 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol.
What is the SMILES notation for 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol?
The canonical SMILES for 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol is Cc1ccccc1C(CN1CCOCC1)NCC(O)c1ccccc1.
What is the InChIKey of 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol?
The InChIKey is CPNGSAISNBKMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O2/c1-17-7-5-6-10-19(17)20(16-23-11-13-25-14-12-23)22-15-21(24)18-8-3-2-4-9-18/h2-10,20-22,24H,11-16H2,1H3.
What are the key properties of 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol?
2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol has a molecular weight of 340.47 g/mol, XLogP of 2.69, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-methylphenyl)-2-morpholin-4-ylethyl]amino]-1-phenylethanol is sourced from PubChem (CID 146081346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).