(2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine

C20H32N2O2 — CID 97322359

IUPAC(2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine
SMILESC[C@@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1
InChIInChI=1S/C20H32N2O2/c1-17(19-7-11-23-12-8-19)21-20(15-18-5-3-2-4-6-18)16-22-9-13-24-14-10-22/h2-6,17,19-21H,7-16H2,1H3/t17-,20+/m1/s1
InChIKeyONJKAUSQFHEZOT-XLIONFOSSA-N
MW332.49 g/mol
LogP2.33
Rot. Bonds7

About (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine

(2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine (PubChem CID 97322359) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine.

Molecular Properties

Compound Name(2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine
PubChem CID97322359
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name(2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine
SMILESC[C@@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1
InChIInChI=1S/C20H32N2O2/c1-17(19-7-11-23-12-8-19)21-20(15-18-5-3-2-4-6-18)16-22-9-13-24-14-10-22/h2-6,17,19-21H,7-16H2,1H3/t17-,20+/m1/s1
InChIKeyONJKAUSQFHEZOT-XLIONFOSSA-N
XLogP2.33
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine with MolForge

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Related Compounds

(2S)-2-methoxy-N-[(2R)-1-morpholin-4-yl-3-phenylpropan-2-yl]propanamide
CID 95621536
3-methyl-N-[(2S)-1-morpholin-4-yl-3-phenylpropan-2-yl]butanamide
CID 95621532
3-methyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)butanamide
CID 56787230
2-(cyclopropylmethylamino)-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)acetamide
CID 119883220
4-amino-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)pentanamide;dihydrochloride
CID 120565520
N-(1-cyclobutylethyl)-1-phenylbutan-2-amine
CID 115716509
N-(1-cyclohexylethyl)-1-morpholin-4-ylpropan-2-amine
CID 43779482
[1-(oxan-4-yl)-3-phenylpropan-2-yl]hydrazine
CID 105195157
2,2-dimethyl-N-[(2R)-1-morpholin-4-yl-3-phenylpropan-2-yl]azetidine-1-carboxamide
CID 97220199
3-amino-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)cyclohexane-1-carboxamide
CID 119883214
3-amino-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119883213
(2S)-1-morpholin-4-yl-2-[[(1S)-1-(oxan-4-yl)ethyl]amino]-2-phenylethanone
CID 97227101

Frequently Asked Questions

What is the IUPAC name of (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine?
The IUPAC name of (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine (CID 97322359) is (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine.
What is the SMILES notation for (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine?
The canonical SMILES for (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine is C[C@@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1.
What is the InChIKey of (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine?
The InChIKey is ONJKAUSQFHEZOT-XLIONFOSSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-17(19-7-11-23-12-8-19)21-20(15-18-5-3-2-4-6-18)16-22-9-13-24-14-10-22/h2-6,17,19-21H,7-16H2,1H3/t17-,20+/m1/s1.
What are the key properties of (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine?
(2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine has a molecular weight of 332.49 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-morpholin-4-yl-N-[(1R)-1-(oxan-4-yl)ethyl]-3-phenylpropan-2-amine is sourced from PubChem (CID 97322359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).