N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide

C16H24N2O2 — CID 108528705

IUPACN-(2,5-dimethylphenyl)-N',N'-dipropyloxamide
SMILESCCCN(CCC)C(=O)C(=O)Nc1cc(C)ccc1C
InChIInChI=1S/C16H24N2O2/c1-5-9-18(10-6-2)16(20)15(19)17-14-11-12(3)7-8-13(14)4/h7-8,11H,5-6,9-10H2,1-4H3,(H,17,19)
InChIKeyXYWQOOLRENRWPQ-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.89
Rot. Bonds5

About N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide

N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide (PubChem CID 108528705) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-N',N'-dipropyloxamide
PubChem CID108528705
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2,5-dimethylphenyl)-N',N'-dipropyloxamide
SMILESCCCN(CCC)C(=O)C(=O)Nc1cc(C)ccc1C
InChIInChI=1S/C16H24N2O2/c1-5-9-18(10-6-2)16(20)15(19)17-14-11-12(3)7-8-13(14)4/h7-8,11H,5-6,9-10H2,1-4H3,(H,17,19)
InChIKeyXYWQOOLRENRWPQ-UHFFFAOYSA-N
XLogP2.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-butyl-N-(2,5-dimethylphenyl)-N'-methyloxamide
CID 47334597
N-(2-amino-4-methylphenyl)-N'-butyl-N'-propyloxamide
CID 108521655
N-(4-hydroxy-2-methylphenyl)-N',N'-dipropyloxamide
CID 108509587
N-(2-amino-5-methylphenyl)-N',N'-dibutyloxamide
CID 108524625
N-(4-iodo-2-methylphenyl)-N',N'-dipropyloxamide
CID 47335971
N-(2,5-dimethylphenyl)-3-(dipropylamino)propanamide
CID 109033115
N',N'-bis(2-hydroxyethyl)-N-(2-hydroxy-5-methylphenyl)oxamide
CID 108509860
N-(5-methyl-2-pyridinyl)-N',N'-dipropyloxamide
CID 108528764
N'-butyl-N-(2,3-dimethylphenyl)-N'-propyloxamide
CID 108515302
N'-butyl-N-(3-methylphenyl)-N'-propyloxamide
CID 108515660
N-(5-chloro-2-hydroxyphenyl)-N',N'-dipropyloxamide
CID 108519738
3-[[2-(2,5-dimethylanilino)-2-oxoethyl]-propylamino]propanoic acid
CID 82326667

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide?
The IUPAC name of N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide (CID 108528705) is N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide is CCCN(CCC)C(=O)C(=O)Nc1cc(C)ccc1C.
What is the InChIKey of N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide?
The InChIKey is XYWQOOLRENRWPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-5-9-18(10-6-2)16(20)15(19)17-14-11-12(3)7-8-13(14)4/h7-8,11H,5-6,9-10H2,1-4H3,(H,17,19).
What are the key properties of N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide?
N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide has a molecular weight of 276.38 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide is sourced from PubChem (CID 108528705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).