N'-(cyclododecylideneamino)-N-cyclopropyloxamide

C17H29N3O2 — CID 9352147

IUPACN'-(cyclododecylideneamino)-N-cyclopropyloxamide
SMILESO=C(NN=C1CCCCCCCCCCC1)C(=O)NC1CC1
InChIInChI=1S/C17H29N3O2/c21-16(18-14-12-13-14)17(22)20-19-15-10-8-6-4-2-1-3-5-7-9-11-15/h14H,1-13H2,(H,18,21)(H,20,22)
InChIKeySWUASEKVGZOELZ-UHFFFAOYSA-N
MW307.44 g/mol
LogP3.04
Rot. Bonds2

About N'-(cyclododecylideneamino)-N-cyclopropyloxamide

N'-(cyclododecylideneamino)-N-cyclopropyloxamide (PubChem CID 9352147) has the molecular formula C17H29N3O2 and a molecular weight of 307.44 g/mol. Its IUPAC name is N'-(cyclododecylideneamino)-N-cyclopropyloxamide.

Molecular Properties

Compound NameN'-(cyclododecylideneamino)-N-cyclopropyloxamide
PubChem CID9352147
Molecular FormulaC17H29N3O2
Molecular Weight307.44 g/mol
Exact Mass307.23
IUPAC NameN'-(cyclododecylideneamino)-N-cyclopropyloxamide
SMILESO=C(NN=C1CCCCCCCCCCC1)C(=O)NC1CC1
InChIInChI=1S/C17H29N3O2/c21-16(18-14-12-13-14)17(22)20-19-15-10-8-6-4-2-1-3-5-7-9-11-15/h14H,1-13H2,(H,18,21)(H,20,22)
InChIKeySWUASEKVGZOELZ-UHFFFAOYSA-N
XLogP3.04
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-(cyclododecylideneamino)-N-cyclopropyloxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(cyclododecylideneamino)-N-cyclopropyloxamide?
The IUPAC name of N'-(cyclododecylideneamino)-N-cyclopropyloxamide (CID 9352147) is N'-(cyclododecylideneamino)-N-cyclopropyloxamide.
What is the SMILES notation for N'-(cyclododecylideneamino)-N-cyclopropyloxamide?
The canonical SMILES for N'-(cyclododecylideneamino)-N-cyclopropyloxamide is O=C(NN=C1CCCCCCCCCCC1)C(=O)NC1CC1.
What is the InChIKey of N'-(cyclododecylideneamino)-N-cyclopropyloxamide?
The InChIKey is SWUASEKVGZOELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O2/c21-16(18-14-12-13-14)17(22)20-19-15-10-8-6-4-2-1-3-5-7-9-11-15/h14H,1-13H2,(H,18,21)(H,20,22).
What are the key properties of N'-(cyclododecylideneamino)-N-cyclopropyloxamide?
N'-(cyclododecylideneamino)-N-cyclopropyloxamide has a molecular weight of 307.44 g/mol, XLogP of 3.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclododecylideneamino)-N-cyclopropyloxamide is sourced from PubChem (CID 9352147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).