N-cyclododecyl-N'-naphthalen-1-yloxamide

C24H32N2O2 — CID 108517411

IUPACN-cyclododecyl-N'-naphthalen-1-yloxamide
SMILESO=C(Nc1cccc2ccccc12)C(=O)NC1CCCCCCCCCCC1
InChIInChI=1S/C24H32N2O2/c27-23(25-20-15-8-6-4-2-1-3-5-7-9-16-20)24(28)26-22-18-12-14-19-13-10-11-17-21(19)22/h10-14,17-18,20H,1-9,15-16H2,(H,25,27)(H,26,28)
InChIKeyBBYBDTPMNQLIOD-UHFFFAOYSA-N
MW380.53 g/mol
LogP5.57
Rot. Bonds2

About N-cyclododecyl-N'-naphthalen-1-yloxamide

N-cyclododecyl-N'-naphthalen-1-yloxamide (PubChem CID 108517411) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is N-cyclododecyl-N'-naphthalen-1-yloxamide.

Molecular Properties

Compound NameN-cyclododecyl-N'-naphthalen-1-yloxamide
PubChem CID108517411
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC NameN-cyclododecyl-N'-naphthalen-1-yloxamide
SMILESO=C(Nc1cccc2ccccc12)C(=O)NC1CCCCCCCCCCC1
InChIInChI=1S/C24H32N2O2/c27-23(25-20-15-8-6-4-2-1-3-5-7-9-16-20)24(28)26-22-18-12-14-19-13-10-11-17-21(19)22/h10-14,17-18,20H,1-9,15-16H2,(H,25,27)(H,26,28)
InChIKeyBBYBDTPMNQLIOD-UHFFFAOYSA-N
XLogP5.57
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.53
LogP ≤ 55.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-cyclododecyl-N'-naphthalen-1-yloxamide with MolForge

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

Launch Full Analysis

Related Compounds

N'-(2-chlorophenyl)-N-cyclohexyloxamide
CID 7541659
N-cyclopentyl-N'-(2-methylphenyl)oxamide
CID 2290931
N-cyclooctyl-2-(naphthalen-1-ylamino)benzamide
CID 17385247
N-cyclohexyl-N'-(2-ethoxyphenyl)oxamide
CID 7585382
N'-(2-tert-butylphenyl)-N-cycloheptyloxamide
CID 108530177
N-cyclohexyl-N'-phenyloxamide
CID 2271218
N-cyclopentyl-N'-[2-(trifluoromethyl)phenyl]oxamide
CID 45000423
N-cyclopropyl-N'-(2-hydroxyphenyl)oxamide
CID 108514360
1-naphthalen-1-yl-3-piperidin-4-ylurea
CID 16790595
N-cycloheptyl-N'-(2,6-dimethylphenyl)oxamide
CID 7541637
N-[(1R,3R)-3-ethylcyclohexyl]-N'-isoquinolin-5-yloxamide
CID 95775673
trans-(1R,2R)-2-(naphthalen-1-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 823443

Frequently Asked Questions

What is the IUPAC name of N-cyclododecyl-N'-naphthalen-1-yloxamide?
The IUPAC name of N-cyclododecyl-N'-naphthalen-1-yloxamide (CID 108517411) is N-cyclododecyl-N'-naphthalen-1-yloxamide.
What is the SMILES notation for N-cyclododecyl-N'-naphthalen-1-yloxamide?
The canonical SMILES for N-cyclododecyl-N'-naphthalen-1-yloxamide is O=C(Nc1cccc2ccccc12)C(=O)NC1CCCCCCCCCCC1.
What is the InChIKey of N-cyclododecyl-N'-naphthalen-1-yloxamide?
The InChIKey is BBYBDTPMNQLIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c27-23(25-20-15-8-6-4-2-1-3-5-7-9-16-20)24(28)26-22-18-12-14-19-13-10-11-17-21(19)22/h10-14,17-18,20H,1-9,15-16H2,(H,25,27)(H,26,28).
What are the key properties of N-cyclododecyl-N'-naphthalen-1-yloxamide?
N-cyclododecyl-N'-naphthalen-1-yloxamide has a molecular weight of 380.53 g/mol, XLogP of 5.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclododecyl-N'-naphthalen-1-yloxamide is sourced from PubChem (CID 108517411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).