4-(piperazin-1-ylmethyl)-1H-pyridin-2-one

C10H15N3O — CID 82505119

IUPAC4-(piperazin-1-ylmethyl)-1H-pyridin-2-one
SMILESO=c1cc(CN2CCNCC2)cc[nH]1
InChIInChI=1S/C10H15N3O/c14-10-7-9(1-2-12-10)8-13-5-3-11-4-6-13/h1-2,7,11H,3-6,8H2,(H,12,14)
InChIKeyODNLWTGYKNKSDU-UHFFFAOYSA-N
MW193.25 g/mol
LogP-0.22
Rot. Bonds2

About 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one

4-(piperazin-1-ylmethyl)-1H-pyridin-2-one (PubChem CID 82505119) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(piperazin-1-ylmethyl)-1H-pyridin-2-one
PubChem CID82505119
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4-(piperazin-1-ylmethyl)-1H-pyridin-2-one
SMILESO=c1cc(CN2CCNCC2)cc[nH]1
InChIInChI=1S/C10H15N3O/c14-10-7-9(1-2-12-10)8-13-5-3-11-4-6-13/h1-2,7,11H,3-6,8H2,(H,12,14)
InChIKeyODNLWTGYKNKSDU-UHFFFAOYSA-N
XLogP-0.22
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-pyridin-2-one
CID 53191798
4-[[4-(5-methyl-1H-1,2,4-triazol-3-yl)piperazin-1-yl]methyl]-1H-pyridin-2-one
CID 146109753
[3-(piperazin-1-ylmethyl)phenyl]methanol
CID 23023149
1-methyl-3-[3-(piperazin-1-ylmethyl)phenyl]imidazol-2-one
CID 117433968
azane;1-benzylpiperazine
CID 174866973
1-[(4-ethyl-3-fluorophenyl)methyl]piperazine
CID 122519320
1-[(3-methylphenyl)methyl]piperazine;dihydrochloride
CID 3014358
1-[(3-chloro-4-methylphenyl)methyl]piperazine
CID 63195406
1-[(3-fluorophenyl)methyl]piperazine;dihydrochloride
CID 53422102
1-[3-(piperazin-1-ylmethyl)phenyl]piperazin-2-one
CID 117438752
3,3-dimethyl-5-(piperazin-1-ylmethyl)-1H-indol-2-one
CID 82484213
2-[2-oxo-5-(piperazin-1-ylmethyl)-1-pyridinyl]acetonitrile
CID 82510197

Frequently Asked Questions

What is the IUPAC name of 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one?
The IUPAC name of 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one (CID 82505119) is 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one.
What is the SMILES notation for 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one?
The canonical SMILES for 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one is O=c1cc(CN2CCNCC2)cc[nH]1.
What is the InChIKey of 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one?
The InChIKey is ODNLWTGYKNKSDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-10-7-9(1-2-12-10)8-13-5-3-11-4-6-13/h1-2,7,11H,3-6,8H2,(H,12,14).
What are the key properties of 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one?
4-(piperazin-1-ylmethyl)-1H-pyridin-2-one has a molecular weight of 193.25 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperazin-1-ylmethyl)-1H-pyridin-2-one is sourced from PubChem (CID 82505119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).