2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide

C18H26N2O3 — CID 125177222

IUPAC2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide
SMILESO=C(C[C@H]1CNCCO1)NCC1(c2ccccc2)CCOCC1
InChIInChI=1S/C18H26N2O3/c21-17(12-16-13-19-8-11-23-16)20-14-18(6-9-22-10-7-18)15-4-2-1-3-5-15/h1-5,16,19H,6-14H2,(H,20,21)/t16-/m0/s1
InChIKeyPHZGLOICONOVNF-INIZCTEOSA-N
MW318.42 g/mol
LogP1.23
Rot. Bonds5

About 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide

2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide (PubChem CID 125177222) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide
PubChem CID125177222
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide
SMILESO=C(C[C@H]1CNCCO1)NCC1(c2ccccc2)CCOCC1
InChIInChI=1S/C18H26N2O3/c21-17(12-16-13-19-8-11-23-16)20-14-18(6-9-22-10-7-18)15-4-2-1-3-5-15/h1-5,16,19H,6-14H2,(H,20,21)/t16-/m0/s1
InChIKeyPHZGLOICONOVNF-INIZCTEOSA-N
XLogP1.23
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-morpholin-2-yl-N-(2-phenylethyl)acetamide
CID 66434342
2-morpholin-2-yl-N-phenylacetamide;hydrochloride
CID 119670265
N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
CID 114332328
2-(1-hydroxycyclopentyl)-N-[(4-phenyloxan-4-yl)methyl]acetamide
CID 111430576
N-[(4-phenyloxan-4-yl)methyl]-2-phenylsulfanylacetamide
CID 75538689
N-[[1-(dimethylamino)cyclohexyl]methyl]-2-morpholin-2-ylacetamide
CID 66428937
2-morpholin-2-yl-N-[(1-propan-2-ylcyclopropyl)methyl]acetamide;hydrochloride
CID 119801705
N-benzhydryl-2-morpholin-2-ylacetamide;hydrochloride
CID 119675556
3-amino-N-[(4-phenyloxan-4-yl)methyl]butanamide
CID 119731118
4-phenyl-N-[(4-phenyloxan-4-yl)methyl]oxane-4-carboxamide
CID 1082209
N-[(4-phenyloxan-4-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119293530
N-[2-(N-methylanilino)ethyl]-2-morpholin-2-ylacetamide;dihydrochloride
CID 119837655

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide?
The IUPAC name of 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide (CID 125177222) is 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide.
What is the SMILES notation for 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide?
The canonical SMILES for 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide is O=C(C[C@H]1CNCCO1)NCC1(c2ccccc2)CCOCC1.
What is the InChIKey of 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide?
The InChIKey is PHZGLOICONOVNF-INIZCTEOSA-N. The full InChI is InChI=1S/C18H26N2O3/c21-17(12-16-13-19-8-11-23-16)20-14-18(6-9-22-10-7-18)15-4-2-1-3-5-15/h1-5,16,19H,6-14H2,(H,20,21)/t16-/m0/s1.
What are the key properties of 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide?
2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide has a molecular weight of 318.42 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-morpholin-2-yl]-N-[(4-phenyloxan-4-yl)methyl]acetamide is sourced from PubChem (CID 125177222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).