(2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide

C11H15N3O2 — CID 92856892

IUPAC(2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide
SMILESCN(C)/C=N/NC(=O)[C@H](O)c1ccccc1
InChIInChI=1S/C11H15N3O2/c1-14(2)8-12-13-11(16)10(15)9-6-4-3-5-7-9/h3-8,10,15H,1-2H3,(H,13,16)/b12-8+/t10-/m1/s1
InChIKeyKTRMAOMFGCFLGO-ZDIKFAODSA-N
MW221.26 g/mol
LogP0.34
Rot. Bonds4

About (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide

(2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide (PubChem CID 92856892) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide
PubChem CID92856892
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name(2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide
SMILESCN(C)/C=N/NC(=O)[C@H](O)c1ccccc1
InChIInChI=1S/C11H15N3O2/c1-14(2)8-12-13-11(16)10(15)9-6-4-3-5-7-9/h3-8,10,15H,1-2H3,(H,13,16)/b12-8+/t10-/m1/s1
InChIKeyKTRMAOMFGCFLGO-ZDIKFAODSA-N
XLogP0.34
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[(Z)-(2,4-dimethylphenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 5414506
(2R)-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-phenylacetamide
CID 135674788
(2S)-2-hydroxy-N-[(Z)-(6-methyl-2-pyridinyl)methylideneamino]-2-phenylacetamide
CID 94849044
2-hydroxy-N',N'-dimethyl-2-phenylacetohydrazide
CID 11298492
(2R)-2-hydroxy-N-[(Z)-(2-hydroxy-4-methylphenyl)methylideneamino]-2-phenylacetamide
CID 136912785
(2R)-N-[[4-(diethylamino)phenyl]methylideneamino]-2-hydroxy-2-phenylacetamide
CID 828197
N-[(Z)-(4-ethylphenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 6087706
(2R)-2-hydroxy-N-[(Z)-(4-methoxyphenyl)methylideneamino]-2-phenylacetamide
CID 40516770
2-hydroxy-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-2-phenylacetamide;hydrochloride
CID 163329108
(2S)-N-[(Z)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 126270849
2-hydroxy-N-(pentan-3-ylideneamino)-2-phenylacetamide
CID 3532425
(2R)-N-[(Z)-anthracen-9-ylmethylideneamino]-2-hydroxy-2-phenylacetamide
CID 5435830

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide?
The IUPAC name of (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide (CID 92856892) is (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide?
The canonical SMILES for (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide is CN(C)/C=N/NC(=O)[C@H](O)c1ccccc1.
What is the InChIKey of (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide?
The InChIKey is KTRMAOMFGCFLGO-ZDIKFAODSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-14(2)8-12-13-11(16)10(15)9-6-4-3-5-7-9/h3-8,10,15H,1-2H3,(H,13,16)/b12-8+/t10-/m1/s1.
What are the key properties of (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide?
(2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide has a molecular weight of 221.26 g/mol, XLogP of 0.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(E)-dimethylaminomethylideneamino]-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 92856892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).