N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide

C24H32N2O2 — CID 108523671

IUPACN,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide
SMILESCC(C)CN(CC(C)C)C(=O)C(=O)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C24H32N2O2/c1-19(2)15-25(16-20(3)4)23(27)24(28)26(17-21-11-7-5-8-12-21)18-22-13-9-6-10-14-22/h5-14,19-20H,15-18H2,1-4H3
InChIKeyMPEAAJNKQXCOCV-UHFFFAOYSA-N
MW380.53 g/mol
LogP4.36
Rot. Bonds8

About N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide

N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide (PubChem CID 108523671) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide.

Molecular Properties

Compound NameN,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide
PubChem CID108523671
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC NameN,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide
SMILESCC(C)CN(CC(C)C)C(=O)C(=O)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C24H32N2O2/c1-19(2)15-25(16-20(3)4)23(27)24(28)26(17-21-11-7-5-8-12-21)18-22-13-9-6-10-14-22/h5-14,19-20H,15-18H2,1-4H3
InChIKeyMPEAAJNKQXCOCV-UHFFFAOYSA-N
XLogP4.36
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide
CID 108520978
N,N'-dibenzyl-N,N'-diethyloxamide
CID 3417048
N',N'-dibenzyl-N-(2-methylpropyl)oxamide
CID 108504849
N,N,N',N'-tetrakis(2-methylpropyl)oxamide
CID 4523531
(3R,4R)-N,N,N',N'-tetrabenzyl-3,4-dimethylhexanediamide
CID 100939572
N,N-bis(2-methylpropyl)-2-phenylprop-2-enamide
CID 102170630
N-benzyl-2-bromo-N-ethylpropanamide
CID 82108939
benzyl-(2-bromo-2-methoxyethyl)carbamic acid
CID 68692716
1,1-dibenzyl-3-propan-2-ylurea
CID 23988482
3-[benzoyl(benzyl)amino]-2-methylpropanoic acid
CID 82324559
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
[(2R,3S)-3-amino-2-hydroxy-4-phenylbutyl]-(2-methylpropyl)carbamic acid
CID 68714572

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide?
The IUPAC name of N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide (CID 108523671) is N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide.
What is the SMILES notation for N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide?
The canonical SMILES for N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide is CC(C)CN(CC(C)C)C(=O)C(=O)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide?
The InChIKey is MPEAAJNKQXCOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-19(2)15-25(16-20(3)4)23(27)24(28)26(17-21-11-7-5-8-12-21)18-22-13-9-6-10-14-22/h5-14,19-20H,15-18H2,1-4H3.
What are the key properties of N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide?
N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide has a molecular weight of 380.53 g/mol, XLogP of 4.36, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide is sourced from PubChem (CID 108523671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).