4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide

C13H28N2O2 — CID 89111615

IUPAC4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide
SMILESCC(C)N(C)CC(O)CCC(=O)N(C)C(C)C
InChIInChI=1S/C13H28N2O2/c1-10(2)14(5)9-12(16)7-8-13(17)15(6)11(3)4/h10-12,16H,7-9H2,1-6H3
InChIKeyXJZKLFKWMFFOPE-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.33
Rot. Bonds7

About 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide

4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide (PubChem CID 89111615) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide
PubChem CID89111615
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide
SMILESCC(C)N(C)CC(O)CCC(=O)N(C)C(C)C
InChIInChI=1S/C13H28N2O2/c1-10(2)14(5)9-12(16)7-8-13(17)15(6)11(3)4/h10-12,16H,7-9H2,1-6H3
InChIKeyXJZKLFKWMFFOPE-UHFFFAOYSA-N
XLogP1.33
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide?
The IUPAC name of 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide (CID 89111615) is 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide.
What is the SMILES notation for 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide?
The canonical SMILES for 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide is CC(C)N(C)CC(O)CCC(=O)N(C)C(C)C.
What is the InChIKey of 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide?
The InChIKey is XJZKLFKWMFFOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-10(2)14(5)9-12(16)7-8-13(17)15(6)11(3)4/h10-12,16H,7-9H2,1-6H3.
What are the key properties of 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide?
4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide has a molecular weight of 244.38 g/mol, XLogP of 1.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-5-[methyl(propan-2-yl)amino]-N-propan-2-ylpentanamide is sourced from PubChem (CID 89111615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).