N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide

C11H15N3O2 — CID 44997659

IUPACN-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide
SMILESCc1cccc(NC(=O)C(=O)NC(C)C)n1
InChIInChI=1S/C11H15N3O2/c1-7(2)12-10(15)11(16)14-9-6-4-5-8(3)13-9/h4-7H,1-3H3,(H,12,15)(H,13,14,16)
InChIKeyRPYRORXEAYFPCE-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.85
Rot. Bonds2

About N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide

N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide (PubChem CID 44997659) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide
PubChem CID44997659
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide
SMILESCc1cccc(NC(=O)C(=O)NC(C)C)n1
InChIInChI=1S/C11H15N3O2/c1-7(2)12-10(15)11(16)14-9-6-4-5-8(3)13-9/h4-7H,1-3H3,(H,12,15)(H,13,14,16)
InChIKeyRPYRORXEAYFPCE-UHFFFAOYSA-N
XLogP0.85
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-tert-butyl-N-(6-methyl-2-pyridinyl)oxamide
CID 44997660
N-(6-methyl-2-pyridinyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 108519296
N-(2-methylphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997672
N-(6-methyl-2-pyridinyl)propanamide
CID 5057760
N'-(3-hydroxy-1-phenylpropyl)-N-(6-methyl-2-pyridinyl)oxamide
CID 86807653
2-amino-N-(6-methyl-2-pyridinyl)propanamide
CID 60731757
N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide
CID 108519128
(2S)-2-amino-3-methyl-N-(6-methyl-2-pyridinyl)butanamide
CID 22689866
N'-(6-methyl-2-pyridinyl)-N-(3-propan-2-yloxypropyl)oxamide
CID 108525224
N-(4-carbamoylphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 108525732
N-(6-methyl-2-pyridinyl)-2-phenylpropanamide
CID 70678328
N-(2-methoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997668

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide (CID 44997659) is N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide is Cc1cccc(NC(=O)C(=O)NC(C)C)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide?
The InChIKey is RPYRORXEAYFPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7(2)12-10(15)11(16)14-9-6-4-5-8(3)13-9/h4-7H,1-3H3,(H,12,15)(H,13,14,16).
What are the key properties of N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide?
N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide has a molecular weight of 221.26 g/mol, XLogP of 0.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide is sourced from PubChem (CID 44997659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).