(2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide

C19H22N2O3 — CID 7034098

IUPAC(2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide
SMILESCCCOc1ccccc1/C=N\NC(=O)[C@@H](OC)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-3-13-24-17-12-8-7-11-16(17)14-20-21-19(22)18(23-2)15-9-5-4-6-10-15/h4-12,14,18H,3,13H2,1-2H3,(H,21,22)/b20-14-/t18-/m0/s1
InChIKeyLRRHKNYDYZOUKB-HJHGFDQJSA-N
MW326.40 g/mol
LogP3.31
Rot. Bonds8

About (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide

(2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide (PubChem CID 7034098) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name(2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide
PubChem CID7034098
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name(2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide
SMILESCCCOc1ccccc1/C=N\NC(=O)[C@@H](OC)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-3-13-24-17-12-8-7-11-16(17)14-20-21-19(22)18(23-2)15-9-5-4-6-10-15/h4-12,14,18H,3,13H2,1-2H3,(H,21,22)/b20-14-/t18-/m0/s1
InChIKeyLRRHKNYDYZOUKB-HJHGFDQJSA-N
XLogP3.31
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[(E)-(2-methoxyphenyl)methylideneamino]-2-phenylacetamide
CID 5334215
(2S)-N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-methoxy-2-phenylacetamide
CID 136757922
1,3-bis[(E)-(2-propoxyphenyl)methylideneamino]urea
CID 5332460
2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide
CID 6872121
N-[(E)-(2-ethoxyphenyl)methylideneamino]-2-methylpropanamide
CID 94833649
2-(2-bromophenoxy)-N-[(2-propoxyphenyl)methylideneamino]propanamide
CID 3406377
N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]-2-methoxy-2-phenylacetamide
CID 135537540
N-[(2-propoxyphenyl)methylideneamino]cyclopropanecarboxamide
CID 24819076
4-methyl-N-[(2-propoxyphenyl)methylideneamino]benzamide
CID 5131862
4-hydroxy-N-[(2-propoxyphenyl)methylideneamino]benzamide
CID 4300474
N-[(2R)-butan-2-yl]-N'-[(Z)-(2-propoxyphenyl)methylideneamino]oxamide
CID 8988811
N-[(2-pentoxyphenyl)methylideneamino]benzamide
CID 5219776

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide?
The IUPAC name of (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide (CID 7034098) is (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide is CCCOc1ccccc1/C=N\NC(=O)[C@@H](OC)c1ccccc1.
What is the InChIKey of (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide?
The InChIKey is LRRHKNYDYZOUKB-HJHGFDQJSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-13-24-17-12-8-7-11-16(17)14-20-21-19(22)18(23-2)15-9-5-4-6-10-15/h4-12,14,18H,3,13H2,1-2H3,(H,21,22)/b20-14-/t18-/m0/s1.
What are the key properties of (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide?
(2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide has a molecular weight of 326.40 g/mol, XLogP of 3.31, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-2-phenyl-N-[(Z)-(2-propoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 7034098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).