(2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide

C20H24N2O3 — CID 125486482

IUPAC(2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide
SMILESCCNC(=O)[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)CCO1
InChIInChI=1S/C20H24N2O3/c1-2-21-20(23)19-15-22(11-12-24-19)14-16-7-6-10-18(13-16)25-17-8-4-3-5-9-17/h3-10,13,19H,2,11-12,14-15H2,1H3,(H,21,23)/t19-/m0/s1
InChIKeyPXFOQXVNBLHQNR-IBGZPJMESA-N
MW340.42 g/mol
LogP2.82
Rot. Bonds6

About (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide

(2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide (PubChem CID 125486482) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide
PubChem CID125486482
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name(2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide
SMILESCCNC(=O)[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)CCO1
InChIInChI=1S/C20H24N2O3/c1-2-21-20(23)19-15-22(11-12-24-19)14-16-7-6-10-18(13-16)25-17-8-4-3-5-9-17/h3-10,13,19H,2,11-12,14-15H2,1H3,(H,21,23)/t19-/m0/s1
InChIKeyPXFOQXVNBLHQNR-IBGZPJMESA-N
XLogP2.82
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-4-benzyl-N-(2-methoxyethyl)morpholine-2-carboxamide
CID 95636050
cyclopropyl-[(2S)-4-[(3-methoxyphenyl)methyl]morpholin-2-yl]methanone
CID 99786810
4-[[[(2S)-4-benzylmorpholine-2-carbonyl]amino]methyl]benzoic acid
CID 124703916
(2S)-4-benzyl-N-[(3-ethyl-1H-pyrazol-5-yl)methyl]morpholine-2-carboxamide
CID 95775991
(2S)-2-[(4-benzylmorpholine-2-carbonyl)amino]hexanoic acid
CID 120615247
N-ethyl-2-[4-[(3-phenoxyphenyl)methyl]morpholin-3-yl]acetamide
CID 56897356
(2S)-4-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]morpholine-2-carboxylic acid
CID 125438870
(2S)-4-benzyl-N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]morpholine-2-carboxamide
CID 95775872
N-(2-amino-5-methoxyphenyl)-4-benzylmorpholine-2-carboxamide
CID 119420780
N-[[1-[(3-phenoxyphenyl)methyl]piperidin-4-yl]methyl]cyclopropanecarboxamide
CID 131895443
(2S,4S)-1-benzyl-N-ethyl-4-[(3-phenoxyphenyl)methylamino]pyrrolidine-2-carboxamide
CID 45249488
(2R)-4-ethyl-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]morpholine-2-carboxamide
CID 95909052

Frequently Asked Questions

What is the IUPAC name of (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide?
The IUPAC name of (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide (CID 125486482) is (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide.
What is the SMILES notation for (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide?
The canonical SMILES for (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide is CCNC(=O)[C@@H]1CN(Cc2cccc(Oc3ccccc3)c2)CCO1.
What is the InChIKey of (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide?
The InChIKey is PXFOQXVNBLHQNR-IBGZPJMESA-N. The full InChI is InChI=1S/C20H24N2O3/c1-2-21-20(23)19-15-22(11-12-24-19)14-16-7-6-10-18(13-16)25-17-8-4-3-5-9-17/h3-10,13,19H,2,11-12,14-15H2,1H3,(H,21,23)/t19-/m0/s1.
What are the key properties of (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide?
(2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-ethyl-4-[(3-phenoxyphenyl)methyl]morpholine-2-carboxamide is sourced from PubChem (CID 125486482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).