N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide

C17H26N2O2 — CID 108520978

IUPACN-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide
SMILESCC(C)CN(CC(C)C)C(=O)C(=O)N(C)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-13(2)11-19(12-14(3)4)17(21)16(20)18(5)15-9-7-6-8-10-15/h6-10,13-14H,11-12H2,1-5H3
InChIKeyNTJJWHZGZZXXMP-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.79
Rot. Bonds5

About N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide

N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide (PubChem CID 108520978) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide.

Molecular Properties

Compound NameN-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide
PubChem CID108520978
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide
SMILESCC(C)CN(CC(C)C)C(=O)C(=O)N(C)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-13(2)11-19(12-14(3)4)17(21)16(20)18(5)15-9-7-6-8-10-15/h6-10,13-14H,11-12H2,1-5H3
InChIKeyNTJJWHZGZZXXMP-UHFFFAOYSA-N
XLogP2.79
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.79
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,N-dibenzyl-N',N'-bis(2-methylpropyl)oxamide
CID 108523671
N,N,N',N'-tetrakis(2-methylpropyl)oxamide
CID 4523531
N,N-bis(2-methylpropyl)-2-phenylprop-2-enamide
CID 102170630
(E)-N,2-dimethyl-N-phenylbut-2-enamide
CID 10867125
N-benzyl-N,N'-dimethyl-N'-phenyloxamide
CID 108518736
N,3-dimethyl-N-phenylpentanamide
CID 147359069
N-(2-methylpropyl)-N-phenylcarbamoyl chloride
CID 20551108
2-(N-[ethyl(2-methylpropyl)carbamoyl]anilino)acetic acid
CID 61199656
N,N-bis(2-methylpropyl)aniline
CID 5169898
CID 134840608
CID 134840608
formic acid;methyl(phenyl)carbamic acid
CID 161284118
(2R)-2-methyl-3-(N-methylanilino)propanoic acid
CID 94253746

Frequently Asked Questions

What is the IUPAC name of N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide?
The IUPAC name of N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide (CID 108520978) is N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide.
What is the SMILES notation for N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide?
The canonical SMILES for N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide is CC(C)CN(CC(C)C)C(=O)C(=O)N(C)c1ccccc1.
What is the InChIKey of N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide?
The InChIKey is NTJJWHZGZZXXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(2)11-19(12-14(3)4)17(21)16(20)18(5)15-9-7-6-8-10-15/h6-10,13-14H,11-12H2,1-5H3.
What are the key properties of N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide?
N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide has a molecular weight of 290.41 g/mol, XLogP of 2.79, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N',N'-bis(2-methylpropyl)-N-phenyloxamide is sourced from PubChem (CID 108520978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).