N',N'-dipropyl-N-pyridin-2-yloxamide

C13H19N3O2 — CID 108525916

IUPACN',N'-dipropyl-N-pyridin-2-yloxamide
SMILESCCCN(CCC)C(=O)C(=O)Nc1ccccn1
InChIInChI=1S/C13H19N3O2/c1-3-9-16(10-4-2)13(18)12(17)15-11-7-5-6-8-14-11/h5-8H,3-4,9-10H2,1-2H3,(H,14,15,17)
InChIKeyRQHJVRKEVAVOIS-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.67
Rot. Bonds5

About N',N'-dipropyl-N-pyridin-2-yloxamide

N',N'-dipropyl-N-pyridin-2-yloxamide (PubChem CID 108525916) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is N',N'-dipropyl-N-pyridin-2-yloxamide.

Molecular Properties

Compound NameN',N'-dipropyl-N-pyridin-2-yloxamide
PubChem CID108525916
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC NameN',N'-dipropyl-N-pyridin-2-yloxamide
SMILESCCCN(CCC)C(=O)C(=O)Nc1ccccn1
InChIInChI=1S/C13H19N3O2/c1-3-9-16(10-4-2)13(18)12(17)15-11-7-5-6-8-14-11/h5-8H,3-4,9-10H2,1-2H3,(H,14,15,17)
InChIKeyRQHJVRKEVAVOIS-UHFFFAOYSA-N
XLogP1.67
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-ethyl-N'-(2-hydroxyethyl)-N-pyridin-2-yloxamide
CID 108525117
N-(5-methyl-2-pyridinyl)-N',N'-dipropyloxamide
CID 108528764
molecular hydrogen;N-pyridin-2-ylbutanamide
CID 142960531
N-(2-ethoxyphenyl)-N',N'-dipropyloxamide
CID 108528706
N,N'-dipyridin-2-ylbutanediamide
CID 3684644
N-(2-acetamidoethyl)-N'-pyridin-2-yloxamide
CID 108525945
N'-acetyl-N'-(3-aminophenyl)-N-pyridin-2-yloxamide
CID 108525895
N-(4-phenylmethoxyphenyl)-N',N'-dipropyloxamide
CID 108986506
N-(4-iodophenyl)-N',N'-dipropyloxamide
CID 47335998
N,N-dipropyl-2-pyridin-2-ylacetamide
CID 110696960
N-(2-hydroxypropyl)-N'-pyridin-2-yloxamide
CID 44999298
2-(diethylamino)-N-pyridin-2-ylpropanamide
CID 131880299

Frequently Asked Questions

What is the IUPAC name of N',N'-dipropyl-N-pyridin-2-yloxamide?
The IUPAC name of N',N'-dipropyl-N-pyridin-2-yloxamide (CID 108525916) is N',N'-dipropyl-N-pyridin-2-yloxamide.
What is the SMILES notation for N',N'-dipropyl-N-pyridin-2-yloxamide?
The canonical SMILES for N',N'-dipropyl-N-pyridin-2-yloxamide is CCCN(CCC)C(=O)C(=O)Nc1ccccn1.
What is the InChIKey of N',N'-dipropyl-N-pyridin-2-yloxamide?
The InChIKey is RQHJVRKEVAVOIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-3-9-16(10-4-2)13(18)12(17)15-11-7-5-6-8-14-11/h5-8H,3-4,9-10H2,1-2H3,(H,14,15,17).
What are the key properties of N',N'-dipropyl-N-pyridin-2-yloxamide?
N',N'-dipropyl-N-pyridin-2-yloxamide has a molecular weight of 249.31 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dipropyl-N-pyridin-2-yloxamide is sourced from PubChem (CID 108525916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).