N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide

C19H22N4O2 — CID 99585219

IUPACN'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide
SMILESCc1ncccc1NC(=O)C(=O)Nc1cccc(N2CCCCC2)c1
InChIInChI=1S/C19H22N4O2/c1-14-17(9-6-10-20-14)22-19(25)18(24)21-15-7-5-8-16(13-15)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyGQRHWTZXYZYXDI-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.96
Rot. Bonds3

About N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide

N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide (PubChem CID 99585219) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide.

Molecular Properties

Compound NameN'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide
PubChem CID99585219
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC NameN'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide
SMILESCc1ncccc1NC(=O)C(=O)Nc1cccc(N2CCCCC2)c1
InChIInChI=1S/C19H22N4O2/c1-14-17(9-6-10-20-14)22-19(25)18(24)21-15-7-5-8-16(13-15)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyGQRHWTZXYZYXDI-UHFFFAOYSA-N
XLogP2.96
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-(3-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 166198478
N-(4-piperidin-1-ylphenyl)-N'-quinolin-8-yloxamide
CID 108527715
methyl N-(3-piperidin-1-ylphenyl)carbamate
CID 110362130
2-methyl-N-(3-piperidin-1-ylphenyl)propanamide
CID 47379438
2-methyl-N-(3-piperidin-1-ylphenyl)quinoline-3-carboxamide
CID 86832456
N-[3-(azepan-1-yl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 120704662
2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
1-N-(3-chlorophenyl)-4-N-(2-methyl-3-pyridinyl)piperazine-1,4-dicarboxamide
CID 167975602
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
2-amino-N-[3-(azepan-1-yl)phenyl]acetamide
CID 119892163
N'-(2,3-dimethylphenyl)-N-(4-pyrrolidin-1-ylphenyl)oxamide
CID 108986873
N-[3-(azepan-1-yl)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119892181

Frequently Asked Questions

What is the IUPAC name of N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide?
The IUPAC name of N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide (CID 99585219) is N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide.
What is the SMILES notation for N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide?
The canonical SMILES for N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide is Cc1ncccc1NC(=O)C(=O)Nc1cccc(N2CCCCC2)c1.
What is the InChIKey of N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide?
The InChIKey is GQRHWTZXYZYXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-14-17(9-6-10-20-14)22-19(25)18(24)21-15-7-5-8-16(13-15)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide?
N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide has a molecular weight of 338.41 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methyl-3-pyridinyl)-N-(3-piperidin-1-ylphenyl)oxamide is sourced from PubChem (CID 99585219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).