2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide

C10H21NO2 — CID 39237968

IUPAC2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
SMILESCCC(CC)C(=O)NC(C)(C)CO
InChIInChI=1S/C10H21NO2/c1-5-8(6-2)9(13)11-10(3,4)7-12/h8,12H,5-7H2,1-4H3,(H,11,13)
InChIKeyGCZDNDZDHKTIPZ-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.31
Rot. Bonds5

About 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide

2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide (PubChem CID 39237968) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide.

Molecular Properties

Compound Name2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
PubChem CID39237968
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
SMILESCCC(CC)C(=O)NC(C)(C)CO
InChIInChI=1S/C10H21NO2/c1-5-8(6-2)9(13)11-10(3,4)7-12/h8,12H,5-7H2,1-4H3,(H,11,13)
InChIKeyGCZDNDZDHKTIPZ-UHFFFAOYSA-N
XLogP1.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
The IUPAC name of 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide (CID 39237968) is 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide.
What is the SMILES notation for 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
The canonical SMILES for 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide is CCC(CC)C(=O)NC(C)(C)CO.
What is the InChIKey of 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
The InChIKey is GCZDNDZDHKTIPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-5-8(6-2)9(13)11-10(3,4)7-12/h8,12H,5-7H2,1-4H3,(H,11,13).
What are the key properties of 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide?
2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide has a molecular weight of 187.28 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1-hydroxy-2-methylpropan-2-yl)butanamide is sourced from PubChem (CID 39237968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).