N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide

C14H20N2O3 — CID 108520926

IUPACN-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide
SMILESCN(C(=O)C(=O)NCCCCCO)c1ccccc1
InChIInChI=1S/C14H20N2O3/c1-16(12-8-4-2-5-9-12)14(19)13(18)15-10-6-3-7-11-17/h2,4-5,8-9,17H,3,6-7,10-11H2,1H3,(H,15,18)
InChIKeyNXSVDSIPPLKWFF-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.93
Rot. Bonds6

About N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide

N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide (PubChem CID 108520926) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide
PubChem CID108520926
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide
SMILESCN(C(=O)C(=O)NCCCCCO)c1ccccc1
InChIInChI=1S/C14H20N2O3/c1-16(12-8-4-2-5-9-12)14(19)13(18)15-10-6-3-7-11-17/h2,4-5,8-9,17H,3,6-7,10-11H2,1H3,(H,15,18)
InChIKeyNXSVDSIPPLKWFF-UHFFFAOYSA-N
XLogP0.93
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(diethylamino)propyl]-N'-methyl-N'-phenyloxamide
CID 108520921
N-(2-acetamidoethyl)-N'-methyl-N'-phenyloxamide
CID 47333935
N-(6-hydroxyhexyl)-N'-phenyloxamide
CID 50850958
N-[(4-fluorophenyl)methyl]-N'-methyl-N'-phenyloxamide
CID 87039327
N'-(4-hydroxyphenyl)-N-(3-methoxypropyl)-N'-methyloxamide
CID 108506421
6-[2-(N-methylanilino)ethylamino]hexan-1-ol
CID 70258646
N'-benzyl-N-[3-(dimethylamino)propyl]-N'-(2-hydroxyethyl)oxamide
CID 108523741
N-(5-hydroxypentyl)-N'-(2-propan-2-ylphenyl)oxamide
CID 108500540
2-methyl-N-[3-(N-methylanilino)propyl]prop-2-enamide
CID 154634175
2-amino-N-(5-hydroxypentyl)-2-phenylacetamide
CID 69266542
N-(2-fluorophenyl)-N'-methyl-N'-phenyloxamide
CID 108520782
1-benzyl-3-(5-hydroxypentyl)urea
CID 108871315

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide?
The IUPAC name of N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide (CID 108520926) is N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide.
What is the SMILES notation for N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide?
The canonical SMILES for N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide is CN(C(=O)C(=O)NCCCCCO)c1ccccc1.
What is the InChIKey of N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide?
The InChIKey is NXSVDSIPPLKWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-16(12-8-4-2-5-9-12)14(19)13(18)15-10-6-3-7-11-17/h2,4-5,8-9,17H,3,6-7,10-11H2,1H3,(H,15,18).
What are the key properties of N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide?
N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide has a molecular weight of 264.32 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)-N'-methyl-N'-phenyloxamide is sourced from PubChem (CID 108520926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).