N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide

C16H23N3O2 — CID 7585513

IUPACN-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide
SMILESCN(C)c1ccc(NC(=O)C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C16H23N3O2/c1-19(2)14-10-8-13(9-11-14)18-16(21)15(20)17-12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyURIQKFUFJGAJRA-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.14
Rot. Bonds3

About N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide

N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide (PubChem CID 7585513) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide.

Molecular Properties

Compound NameN-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide
PubChem CID7585513
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide
SMILESCN(C)c1ccc(NC(=O)C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C16H23N3O2/c1-19(2)14-10-8-13(9-11-14)18-16(21)15(20)17-12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyURIQKFUFJGAJRA-UHFFFAOYSA-N
XLogP2.14
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-cycloheptyl-N'-(4-methylphenyl)oxamide
CID 2287607
N-cyclododecyl-N'-(4-methylphenyl)oxamide
CID 2924110
N-cyclohexyl-N'-phenyloxamide
CID 2271218
N-cycloheptyl-N'-(4-propan-2-yloxyphenyl)oxamide
CID 108986381
N'-(4-butylphenyl)-N-cycloheptyloxamide
CID 108502498
N'-cycloheptyl-N-[2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]oxamide
CID 18583526
N'-cycloheptyl-N-[2-[4-(dimethylamino)phenyl]-2-hydroxyethyl]oxamide
CID 90581640
N-cyclopentyl-N'-[4-(trifluoromethyl)phenyl]oxamide
CID 18588731
N-cyclohexyl-N'-(3,4-dichlorophenyl)oxamide
CID 2058101
N-cycloheptyl-N'-(3-fluoro-4-methylphenyl)oxamide
CID 7585166
3-(cyclopentylamino)-N-[4-(dimethylamino)phenyl]propanamide
CID 109013731
N-cyclopentyl-N'-[4-(4-methylpiperazin-1-yl)phenyl]oxamide
CID 108505990

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide?
The IUPAC name of N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide (CID 7585513) is N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide.
What is the SMILES notation for N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide?
The canonical SMILES for N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide is CN(C)c1ccc(NC(=O)C(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide?
The InChIKey is URIQKFUFJGAJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-19(2)14-10-8-13(9-11-14)18-16(21)15(20)17-12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide?
N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide has a molecular weight of 289.38 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-[4-(dimethylamino)phenyl]oxamide is sourced from PubChem (CID 7585513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).