N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide

C15H31NO2 — CID 72941560

IUPACN-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide
SMILESCC(C)C(C(=O)NC(C)(C)CO)(C(C)C)C(C)C
InChIInChI=1S/C15H31NO2/c1-10(2)15(11(3)4,12(5)6)13(18)16-14(7,8)9-17/h10-12,17H,9H2,1-8H3,(H,16,18)
InChIKeyGZJLOYCAYZLBKN-UHFFFAOYSA-N
MW257.42 g/mol
LogP2.83
Rot. Bonds6

About N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide

N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide (PubChem CID 72941560) has the molecular formula C15H31NO2 and a molecular weight of 257.42 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide
PubChem CID72941560
Molecular FormulaC15H31NO2
Molecular Weight257.42 g/mol
Exact Mass257.24
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide
SMILESCC(C)C(C(=O)NC(C)(C)CO)(C(C)C)C(C)C
InChIInChI=1S/C15H31NO2/c1-10(2)15(11(3)4,12(5)6)13(18)16-14(7,8)9-17/h10-12,17H,9H2,1-8H3,(H,16,18)
InChIKeyGZJLOYCAYZLBKN-UHFFFAOYSA-N
XLogP2.83
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide (CID 72941560) is N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide is CC(C)C(C(=O)NC(C)(C)CO)(C(C)C)C(C)C.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide?
The InChIKey is GZJLOYCAYZLBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO2/c1-10(2)15(11(3)4,12(5)6)13(18)16-14(7,8)9-17/h10-12,17H,9H2,1-8H3,(H,16,18).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide?
N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide has a molecular weight of 257.42 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)-3-methyl-2,2-di(propan-2-yl)butanamide is sourced from PubChem (CID 72941560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).