N-butyl-2-hydroxy-N-methylacetamide

C7H15NO2 — CID 13241437

IUPACN-butyl-2-hydroxy-N-methylacetamide
SMILESCCCCN(C)C(=O)CO
InChIInChI=1S/C7H15NO2/c1-3-4-5-8(2)7(10)6-9/h9H,3-6H2,1-2H3
InChIKeyOECLKMSYWCPFNW-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.24
Rot. Bonds4

About N-butyl-2-hydroxy-N-methylacetamide

N-butyl-2-hydroxy-N-methylacetamide (PubChem CID 13241437) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is N-butyl-2-hydroxy-N-methylacetamide.

Molecular Properties

Compound NameN-butyl-2-hydroxy-N-methylacetamide
PubChem CID13241437
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC NameN-butyl-2-hydroxy-N-methylacetamide
SMILESCCCCN(C)C(=O)CO
InChIInChI=1S/C7H15NO2/c1-3-4-5-8(2)7(10)6-9/h9H,3-6H2,1-2H3
InChIKeyOECLKMSYWCPFNW-UHFFFAOYSA-N
XLogP0.24
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-butyl-2-hydroxy-N-methylacetamide?
The IUPAC name of N-butyl-2-hydroxy-N-methylacetamide (CID 13241437) is N-butyl-2-hydroxy-N-methylacetamide.
What is the SMILES notation for N-butyl-2-hydroxy-N-methylacetamide?
The canonical SMILES for N-butyl-2-hydroxy-N-methylacetamide is CCCCN(C)C(=O)CO.
What is the InChIKey of N-butyl-2-hydroxy-N-methylacetamide?
The InChIKey is OECLKMSYWCPFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-3-4-5-8(2)7(10)6-9/h9H,3-6H2,1-2H3.
What are the key properties of N-butyl-2-hydroxy-N-methylacetamide?
N-butyl-2-hydroxy-N-methylacetamide has a molecular weight of 145.20 g/mol, XLogP of 0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-hydroxy-N-methylacetamide is sourced from PubChem (CID 13241437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).