2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide

C9H18N2O2 — CID 43218636

IUPAC2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN1CCC(O)CC1
InChIInChI=1S/C9H18N2O2/c1-10(2)9(13)7-11-5-3-8(12)4-6-11/h8,12H,3-7H2,1-2H3
InChIKeyMJBOPNMXUGXHHW-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.47
Rot. Bonds2

About 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide

2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide (PubChem CID 43218636) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide
PubChem CID43218636
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN1CCC(O)CC1
InChIInChI=1S/C9H18N2O2/c1-10(2)9(13)7-11-5-3-8(12)4-6-11/h8,12H,3-7H2,1-2H3
InChIKeyMJBOPNMXUGXHHW-UHFFFAOYSA-N
XLogP-0.47
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide?
The IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide (CID 43218636) is 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide?
The canonical SMILES for 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide is CN(C)C(=O)CN1CCC(O)CC1.
What is the InChIKey of 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide?
The InChIKey is MJBOPNMXUGXHHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-10(2)9(13)7-11-5-3-8(12)4-6-11/h8,12H,3-7H2,1-2H3.
What are the key properties of 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide?
2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide has a molecular weight of 186.25 g/mol, XLogP of -0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxypiperidin-1-yl)-N,N-dimethylacetamide is sourced from PubChem (CID 43218636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).