3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide

C11H24N2O3 — CID 103712270

IUPAC3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide
SMILESCOCCC(C)(O)CNC(=O)CCN(C)C
InChIInChI=1S/C11H24N2O3/c1-11(15,6-8-16-4)9-12-10(14)5-7-13(2)3/h15H,5-9H2,1-4H3,(H,12,14)
InChIKeyQQWGAMSKHUWIKM-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.16
Rot. Bonds8

About 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide

3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide (PubChem CID 103712270) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide
PubChem CID103712270
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide
SMILESCOCCC(C)(O)CNC(=O)CCN(C)C
InChIInChI=1S/C11H24N2O3/c1-11(15,6-8-16-4)9-12-10(14)5-7-13(2)3/h15H,5-9H2,1-4H3,(H,12,14)
InChIKeyQQWGAMSKHUWIKM-UHFFFAOYSA-N
XLogP-0.16
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide?
The IUPAC name of 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide (CID 103712270) is 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide.
What is the SMILES notation for 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide?
The canonical SMILES for 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide is COCCC(C)(O)CNC(=O)CCN(C)C.
What is the InChIKey of 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide?
The InChIKey is QQWGAMSKHUWIKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-11(15,6-8-16-4)9-12-10(14)5-7-13(2)3/h15H,5-9H2,1-4H3,(H,12,14).
What are the key properties of 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide?
3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide has a molecular weight of 232.32 g/mol, XLogP of -0.16, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide is sourced from PubChem (CID 103712270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).