N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide

C15H18N4O4 — CID 108530454

IUPACN-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide
SMILESNC(=O)c1ccc(NC(=O)C(=O)NC(=O)C2CCNCC2)cc1
InChIInChI=1S/C15H18N4O4/c16-12(20)9-1-3-11(4-2-9)18-14(22)15(23)19-13(21)10-5-7-17-8-6-10/h1-4,10,17H,5-8H2,(H2,16,20)(H,18,22)(H,19,21,23)
InChIKeyRRRKZPXJEDJXIG-UHFFFAOYSA-N
MW318.33 g/mol
LogP-0.63
Rot. Bonds3

About N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide

N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide (PubChem CID 108530454) has the molecular formula C15H18N4O4 and a molecular weight of 318.33 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide
PubChem CID108530454
Molecular FormulaC15H18N4O4
Molecular Weight318.33 g/mol
Exact Mass318.13
IUPAC NameN-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide
SMILESNC(=O)c1ccc(NC(=O)C(=O)NC(=O)C2CCNCC2)cc1
InChIInChI=1S/C15H18N4O4/c16-12(20)9-1-3-11(4-2-9)18-14(22)15(23)19-13(21)10-5-7-17-8-6-10/h1-4,10,17H,5-8H2,(H2,16,20)(H,18,22)(H,19,21,23)
InChIKeyRRRKZPXJEDJXIG-UHFFFAOYSA-N
XLogP-0.63
TPSA130.39 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.33
LogP ≤ 5-0.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(1,3-benzodioxol-5-yl)-N'-(piperidine-4-carbonyl)oxamide
CID 108531851
N-(3-chloro-4-fluorophenyl)-N'-(piperidine-4-carbonyl)oxamide
CID 108530544
5-(piperidine-4-carbonylamino)benzene-1,3-dicarboxamide
CID 61276320
N-(3-carbamoylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119270283
N-(4-carbamoylphenyl)-N'-(4-fluorophenyl)oxamide
CID 45001370
methyl 4-(piperidine-4-carbonylamino)benzoate
CID 61258374
N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
CID 110471858
N-(4-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
CID 43706641
N-(4-carbamoylphenyl)-N'-(4-iodophenyl)oxamide
CID 108530450
N-(4-carbamoylphenyl)-4-methylpiperidine-4-carboxamide
CID 63121565
N-[4-[(4-chlorobenzoyl)amino]phenyl]piperidine-4-carboxamide;hydrochloride
CID 119302107
N-(4-formylphenyl)piperidine-4-carboxamide
CID 130269398

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide?
The IUPAC name of N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide (CID 108530454) is N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide is NC(=O)c1ccc(NC(=O)C(=O)NC(=O)C2CCNCC2)cc1.
What is the InChIKey of N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide?
The InChIKey is RRRKZPXJEDJXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O4/c16-12(20)9-1-3-11(4-2-9)18-14(22)15(23)19-13(21)10-5-7-17-8-6-10/h1-4,10,17H,5-8H2,(H2,16,20)(H,18,22)(H,19,21,23).
What are the key properties of N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide?
N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide has a molecular weight of 318.33 g/mol, XLogP of -0.63, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-N'-(piperidine-4-carbonyl)oxamide is sourced from PubChem (CID 108530454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).