N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide

C16H17N3O2 — CID 44997207

IUPACN-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)NC(C)c2ccccc2)nc1
InChIInChI=1S/C16H17N3O2/c1-11-8-9-14(17-10-11)19-16(21)15(20)18-12(2)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H,18,20)(H,17,19,21)
InChIKeyOCOUCOPRXBQLBY-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.21
Rot. Bonds3

About N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide

N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide (PubChem CID 44997207) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide.

Molecular Properties

Compound NameN-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide
PubChem CID44997207
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)NC(C)c2ccccc2)nc1
InChIInChI=1S/C16H17N3O2/c1-11-8-9-14(17-10-11)19-16(21)15(20)18-12(2)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H,18,20)(H,17,19,21)
InChIKeyOCOUCOPRXBQLBY-UHFFFAOYSA-N
XLogP2.21
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(5-methyl-2-pyridinyl)-2-phenylpropanediamide
CID 3419355
(2R)-2-amino-N-(5-methyl-2-pyridinyl)-2-phenylacetamide
CID 61148111
N'-(2-methylphenyl)-N-(5-methyl-2-pyridinyl)oxamide
CID 44997230
N-(1,2-oxazol-3-yl)-N'-[(1R)-1-phenylethyl]oxamide
CID 41452995
2-benzhydrylsulfanyl-N-(5-methyl-2-pyridinyl)acetamide
CID 46651551
1-benzhydryl-3-(5-methyl-2-pyridinyl)thiourea
CID 100664632
N-(5-methyl-2-pyridinyl)-2-phenoxy-2-phenylacetamide
CID 60543327
2-[(5-methyl-2-pyridinyl)sulfanyl]-N-(1-phenylethyl)acetamide
CID 134007796
N'-(5-methyl-2-pyridinyl)-N-(2-phenylethyl)oxamide
CID 44997210
N'-(5-methyl-2-pyridinyl)oxamide
CID 23087857
2-(4-methylphenyl)-2-oxo-N-(1-phenylethyl)acetamide
CID 47121155
1-[(1S)-2-methyl-1-phenylpropyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 97006508

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide?
The IUPAC name of N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide (CID 44997207) is N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide.
What is the SMILES notation for N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide?
The canonical SMILES for N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide is Cc1ccc(NC(=O)C(=O)NC(C)c2ccccc2)nc1.
What is the InChIKey of N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide?
The InChIKey is OCOUCOPRXBQLBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-11-8-9-14(17-10-11)19-16(21)15(20)18-12(2)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H,18,20)(H,17,19,21).
What are the key properties of N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide?
N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide has a molecular weight of 283.33 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridinyl)-N'-(1-phenylethyl)oxamide is sourced from PubChem (CID 44997207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).