N-[4-(hydroxymethyl)oxan-4-yl]pentanamide

C11H21NO3 — CID 103954062

IUPACN-[4-(hydroxymethyl)oxan-4-yl]pentanamide
SMILESCCCCC(=O)NC1(CO)CCOCC1
InChIInChI=1S/C11H21NO3/c1-2-3-4-10(14)12-11(9-13)5-7-15-8-6-11/h13H,2-9H2,1H3,(H,12,14)
InChIKeyGSNAMVABJHNTNA-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.83
Rot. Bonds5

About N-[4-(hydroxymethyl)oxan-4-yl]pentanamide

N-[4-(hydroxymethyl)oxan-4-yl]pentanamide (PubChem CID 103954062) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-[4-(hydroxymethyl)oxan-4-yl]pentanamide.

Molecular Properties

Compound NameN-[4-(hydroxymethyl)oxan-4-yl]pentanamide
PubChem CID103954062
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-[4-(hydroxymethyl)oxan-4-yl]pentanamide
SMILESCCCCC(=O)NC1(CO)CCOCC1
InChIInChI=1S/C11H21NO3/c1-2-3-4-10(14)12-11(9-13)5-7-15-8-6-11/h13H,2-9H2,1H3,(H,12,14)
InChIKeyGSNAMVABJHNTNA-UHFFFAOYSA-N
XLogP0.83
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(hydroxymethyl)oxan-4-yl]pentanamide?
The IUPAC name of N-[4-(hydroxymethyl)oxan-4-yl]pentanamide (CID 103954062) is N-[4-(hydroxymethyl)oxan-4-yl]pentanamide.
What is the SMILES notation for N-[4-(hydroxymethyl)oxan-4-yl]pentanamide?
The canonical SMILES for N-[4-(hydroxymethyl)oxan-4-yl]pentanamide is CCCCC(=O)NC1(CO)CCOCC1.
What is the InChIKey of N-[4-(hydroxymethyl)oxan-4-yl]pentanamide?
The InChIKey is GSNAMVABJHNTNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-2-3-4-10(14)12-11(9-13)5-7-15-8-6-11/h13H,2-9H2,1H3,(H,12,14).
What are the key properties of N-[4-(hydroxymethyl)oxan-4-yl]pentanamide?
N-[4-(hydroxymethyl)oxan-4-yl]pentanamide has a molecular weight of 215.29 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydroxymethyl)oxan-4-yl]pentanamide is sourced from PubChem (CID 103954062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).