N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide

C23H47NO2 — CID 20746135

IUPACN-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide
SMILESCCC(C)C(C)CC(C)CC(C)C(C(=O)NC(C(C)C)C(C)O)C(C)C
InChIInChI=1S/C23H47NO2/c1-11-17(7)18(8)12-16(6)13-19(9)21(14(2)3)23(26)24-22(15(4)5)20(10)25/h14-22,25H,11-13H2,1-10H3,(H,24,26)
InChIKeyIZGGBZKQVYBQEY-UHFFFAOYSA-N
MW369.63 g/mol
LogP5.51
Rot. Bonds12

About N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide

N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide (PubChem CID 20746135) has the molecular formula C23H47NO2 and a molecular weight of 369.63 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide
PubChem CID20746135
Molecular FormulaC23H47NO2
Molecular Weight369.63 g/mol
Exact Mass369.36
IUPAC NameN-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide
SMILESCCC(C)C(C)CC(C)CC(C)C(C(=O)NC(C(C)C)C(C)O)C(C)C
InChIInChI=1S/C23H47NO2/c1-11-17(7)18(8)12-16(6)13-19(9)21(14(2)3)23(26)24-22(15(4)5)20(10)25/h14-22,25H,11-13H2,1-10H3,(H,24,26)
InChIKeyIZGGBZKQVYBQEY-UHFFFAOYSA-N
XLogP5.51
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.63
LogP ≤ 55.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide?
The IUPAC name of N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide (CID 20746135) is N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide.
What is the SMILES notation for N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide?
The canonical SMILES for N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide is CCC(C)C(C)CC(C)CC(C)C(C(=O)NC(C(C)C)C(C)O)C(C)C.
What is the InChIKey of N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide?
The InChIKey is IZGGBZKQVYBQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H47NO2/c1-11-17(7)18(8)12-16(6)13-19(9)21(14(2)3)23(26)24-22(15(4)5)20(10)25/h14-22,25H,11-13H2,1-10H3,(H,24,26).
What are the key properties of N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide?
N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide has a molecular weight of 369.63 g/mol, XLogP of 5.51, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylpentan-3-yl)-3,5,7,8-tetramethyl-2-propan-2-yldecanamide is sourced from PubChem (CID 20746135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).