3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide

C11H22N2O3 — CID 103713019

IUPAC3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide
SMILESCCCC(C)(O)CNC(=O)CCNC(C)=O
InChIInChI=1S/C11H22N2O3/c1-4-6-11(3,16)8-13-10(15)5-7-12-9(2)14/h16H,4-8H2,1-3H3,(H,12,14)(H,13,15)
InChIKeyUZHLMDWWNHEXRB-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.18
Rot. Bonds7

About 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide

3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide (PubChem CID 103713019) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide
PubChem CID103713019
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide
SMILESCCCC(C)(O)CNC(=O)CCNC(C)=O
InChIInChI=1S/C11H22N2O3/c1-4-6-11(3,16)8-13-10(15)5-7-12-9(2)14/h16H,4-8H2,1-3H3,(H,12,14)(H,13,15)
InChIKeyUZHLMDWWNHEXRB-UHFFFAOYSA-N
XLogP0.18
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylamino)-N-(2-hydroxy-2-methylpentyl)propanamide
CID 106292266
4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide
CID 106295714
2-(3-acetamidopropanoylamino)-2-methylpentanoic acid
CID 43618824
N-(2-hydroxy-4-methoxy-2-methylbutyl)butanamide
CID 103712321
N-(2-hydroxy-2-methylpentyl)-2-propoxyacetamide
CID 103713311
3-(tert-butylamino)-N-(2-hydroxy-2-methylbutyl)propanamide
CID 65106616
3-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292069
N-(2-hydroxy-2-methylpentyl)-3-(oxolan-2-yl)propanamide
CID 113246007
N-(2-hydroxy-2-methylpentyl)-2-(prop-2-enylamino)acetamide
CID 106292369
N-(2-hydroxy-2-methylpentyl)-3-(3-propyl-1,2,4-oxadiazol-5-yl)propanamide
CID 103713290
3-(6-acetamidohexanoylamino)-2-hydroxy-2-methylpropanoic acid
CID 66172183
3-(2-chlorophenyl)sulfanyl-N-(2-hydroxy-2-methylpentyl)propanamide
CID 103712971

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide?
The IUPAC name of 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide (CID 103713019) is 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide?
The canonical SMILES for 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide is CCCC(C)(O)CNC(=O)CCNC(C)=O.
What is the InChIKey of 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide?
The InChIKey is UZHLMDWWNHEXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-4-6-11(3,16)8-13-10(15)5-7-12-9(2)14/h16H,4-8H2,1-3H3,(H,12,14)(H,13,15).
What are the key properties of 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide?
3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide has a molecular weight of 230.31 g/mol, XLogP of 0.18, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide is sourced from PubChem (CID 103713019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).