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

C15H25N3O3 — CID 108530968

IUPACN-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide
SMILESO=C(NC(=O)C1CCNCC1)C(=O)NC1CCCCCC1
InChIInChI=1S/C15H25N3O3/c19-13(11-7-9-16-10-8-11)18-15(21)14(20)17-12-5-3-1-2-4-6-12/h11-12,16H,1-10H2,(H,17,20)(H,18,19,21)
InChIKeySARDXPYKXQFSAX-UHFFFAOYSA-N
MW295.38 g/mol
LogP0.47
Rot. Bonds2

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

N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide (PubChem CID 108530968) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide.

Molecular Properties

Compound NameN-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide
PubChem CID108530968
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC NameN-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide
SMILESO=C(NC(=O)C1CCNCC1)C(=O)NC1CCCCCC1
InChIInChI=1S/C15H25N3O3/c19-13(11-7-9-16-10-8-11)18-15(21)14(20)17-12-5-3-1-2-4-6-12/h11-12,16H,1-10H2,(H,17,20)(H,18,19,21)
InChIKeySARDXPYKXQFSAX-UHFFFAOYSA-N
XLogP0.47
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide?
The IUPAC name of N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide (CID 108530968) is N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide.
What is the SMILES notation for N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide?
The canonical SMILES for N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide is O=C(NC(=O)C1CCNCC1)C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide?
The InChIKey is SARDXPYKXQFSAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c19-13(11-7-9-16-10-8-11)18-15(21)14(20)17-12-5-3-1-2-4-6-12/h11-12,16H,1-10H2,(H,17,20)(H,18,19,21).
What are the key properties of N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide?
N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide has a molecular weight of 295.38 g/mol, XLogP of 0.47, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide is sourced from PubChem (CID 108530968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).