N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide

C9H18N2O2 — CID 15291737

IUPACN-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide
SMILESCC(=O)NCC1(O)CCN(C)CC1
InChIInChI=1S/C9H18N2O2/c1-8(12)10-7-9(13)3-5-11(2)6-4-9/h13H,3-7H2,1-2H3,(H,10,12)
InChIKeySEASIAOAVXWYDG-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.42
Rot. Bonds2

About N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide

N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide (PubChem CID 15291737) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide
PubChem CID15291737
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide
SMILESCC(=O)NCC1(O)CCN(C)CC1
InChIInChI=1S/C9H18N2O2/c1-8(12)10-7-9(13)3-5-11(2)6-4-9/h13H,3-7H2,1-2H3,(H,10,12)
InChIKeySEASIAOAVXWYDG-UHFFFAOYSA-N
XLogP-0.42
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
The IUPAC name of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide (CID 15291737) is N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide.
What is the SMILES notation for N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
The canonical SMILES for N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide is CC(=O)NCC1(O)CCN(C)CC1.
What is the InChIKey of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
The InChIKey is SEASIAOAVXWYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-8(12)10-7-9(13)3-5-11(2)6-4-9/h13H,3-7H2,1-2H3,(H,10,12).
What are the key properties of N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide?
N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide has a molecular weight of 186.25 g/mol, XLogP of -0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]acetamide is sourced from PubChem (CID 15291737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).