N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide

C11H16N2O2 — CID 82343736

IUPACN-[6-(hydroxymethyl)-2-pyridinyl]pentanamide
SMILESCCCCC(=O)NC1=CC=CC(=N1)CO
InChIInChI=1S/C11H16N2O2/c1-2-3-7-11(15)13-10-6-4-5-9(8-14)12-10/h4-6,14H,2-3,7-8H2,1H3,(H,12,13,15)
InChIKeyBCRMHWDGWZOFKM-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.90
Rot. Bonds5

About N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide

N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide (PubChem CID 82343736) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide.

Molecular Properties

Compound NameN-[6-(hydroxymethyl)-2-pyridinyl]pentanamide
PubChem CID82343736
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[6-(hydroxymethyl)-2-pyridinyl]pentanamide
SMILESCCCCC(=O)NC1=CC=CC(=N1)CO
InChIInChI=1S/C11H16N2O2/c1-2-3-7-11(15)13-10-6-4-5-9(8-14)12-10/h4-6,14H,2-3,7-8H2,1H3,(H,12,13,15)
InChIKeyBCRMHWDGWZOFKM-UHFFFAOYSA-N
XLogP0.90
TPSA62.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity197

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide?
The IUPAC name of N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide (CID 82343736) is N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide.
What is the SMILES notation for N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide?
The canonical SMILES for N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide is CCCCC(=O)NC1=CC=CC(=N1)CO.
What is the InChIKey of N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide?
The InChIKey is BCRMHWDGWZOFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-2-3-7-11(15)13-10-6-4-5-9(8-14)12-10/h4-6,14H,2-3,7-8H2,1H3,(H,12,13,15).
What are the key properties of N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide?
N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide has a molecular weight of 208.26 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide is sourced from PubChem (CID 82343736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).