N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide

C19H34N2O2 — CID 108966069

IUPACN,N'-di(cycloheptyl)-2,2-dimethylpropanediamide
SMILESCC(C)(C(=O)NC1CCCCCC1)C(=O)NC1CCCCCC1
InChIInChI=1S/C19H34N2O2/c1-19(2,17(22)20-15-11-7-3-4-8-12-15)18(23)21-16-13-9-5-6-10-14-16/h15-16H,3-14H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyHNBZRARDXKMUJG-UHFFFAOYSA-N
MW322.49 g/mol
LogP3.69
Rot. Bonds4

About N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide

N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide (PubChem CID 108966069) has the molecular formula C19H34N2O2 and a molecular weight of 322.49 g/mol. Its IUPAC name is N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide.

Molecular Properties

Compound NameN,N'-di(cycloheptyl)-2,2-dimethylpropanediamide
PubChem CID108966069
Molecular FormulaC19H34N2O2
Molecular Weight322.49 g/mol
Exact Mass322.26
IUPAC NameN,N'-di(cycloheptyl)-2,2-dimethylpropanediamide
SMILESCC(C)(C(=O)NC1CCCCCC1)C(=O)NC1CCCCCC1
InChIInChI=1S/C19H34N2O2/c1-19(2,17(22)20-15-11-7-3-4-8-12-15)18(23)21-16-13-9-5-6-10-14-16/h15-16H,3-14H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyHNBZRARDXKMUJG-UHFFFAOYSA-N
XLogP3.69
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.49
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide 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-tert-butyl-N'-cyclohexyl-2,2-dimethylpropanediamide
CID 108958979
2-chloro-N-cyclohexyl-2-methylpropanamide
CID 70600650
N-cycloheptyl-N'-[2-(dimethylamino)ethyl]-2,2-dimethylpropanediamide
CID 108960232
N-(4-tert-butylphenyl)-N'-cycloheptyl-2,2-dimethylpropanediamide
CID 108966101
N-cyclobutyl-2,2-dimethylpropanamide
CID 21051515
N-(4-bromophenyl)-N'-cyclohexyl-2,2-dimethylpropanediamide
CID 108959030
N-(4-acetamidophenyl)-N'-cyclopentyl-2,2-dimethylpropanediamide
CID 108958674
N-cyclopentyl-2,2-dimethylbutanamide
CID 4627793
N-cyclopentyl-3-hydroxy-2,2-dimethylpropanamide
CID 66746460
N-cycloheptyl-N'-(3,4-dimethylphenyl)-2,2-dimethylpropanediamide
CID 108966089
N-cycloheptyl-3-(4-ethylpiperazin-1-yl)-2,2-dimethyl-3-oxopropanamide
CID 108960902
2-cyano-N-cyclopentyl-2-methylpropanamide
CID 60778685

Frequently Asked Questions

What is the IUPAC name of N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide?
The IUPAC name of N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide (CID 108966069) is N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide.
What is the SMILES notation for N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide?
The canonical SMILES for N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide is CC(C)(C(=O)NC1CCCCCC1)C(=O)NC1CCCCCC1.
What is the InChIKey of N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide?
The InChIKey is HNBZRARDXKMUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2O2/c1-19(2,17(22)20-15-11-7-3-4-8-12-15)18(23)21-16-13-9-5-6-10-14-16/h15-16H,3-14H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide?
N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide has a molecular weight of 322.49 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-di(cycloheptyl)-2,2-dimethylpropanediamide is sourced from PubChem (CID 108966069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).