4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one

C14H21N5O2 — CID 154775681

IUPAC4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one
SMILESO=C1CN(C(=O)CN2CCC(c3ccn[nH]3)CC2)CCN1
InChIInChI=1S/C14H21N5O2/c20-13-9-19(8-5-15-13)14(21)10-18-6-2-11(3-7-18)12-1-4-16-17-12/h1,4,11H,2-3,5-10H2,(H,15,20)(H,16,17)
InChIKeyVDHNDTDBNLIPSL-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.45
Rot. Bonds3

About 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one

4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one (PubChem CID 154775681) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one.

Molecular Properties

Compound Name4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one
PubChem CID154775681
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC Name4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one
SMILESO=C1CN(C(=O)CN2CCC(c3ccn[nH]3)CC2)CCN1
InChIInChI=1S/C14H21N5O2/c20-13-9-19(8-5-15-13)14(21)10-18-6-2-11(3-7-18)12-1-4-16-17-12/h1,4,11H,2-3,5-10H2,(H,15,20)(H,16,17)
InChIKeyVDHNDTDBNLIPSL-UHFFFAOYSA-N
XLogP-0.45
TPSA81.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(4-methylpiperidin-1-yl)acetyl]piperazin-2-one
CID 36800649
3-[2-oxo-2-[(3S)-3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethyl]imidazolidine-2,4-dione
CID 125001259
1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 51104449
4-[2-(1,4-diazepan-1-yl)acetyl]piperazin-2-one
CID 62837528
N-benzyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104503
4-[2-[4-(1,3-thiazol-4-ylmethyl)piperazin-1-yl]acetyl]piperazin-2-one
CID 56799956
4-[2-[(3S)-3-(1,3-benzoxazol-2-yl)piperidin-1-yl]acetyl]piperazin-2-one
CID 37079341
N-(2-cyanoethyl)-N-methyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104425
4-[2-(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)acetyl]piperazin-2-one
CID 86923357
N-(1-cyanocyclopentyl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104474
4-[2-(7-hydroxy-5-azaspiro[2.4]heptan-5-yl)acetyl]piperazin-2-one
CID 167866215
4-[2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]acetyl]piperazin-2-one
CID 120761451

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one?
The IUPAC name of 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one (CID 154775681) is 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one.
What is the SMILES notation for 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one?
The canonical SMILES for 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one is O=C1CN(C(=O)CN2CCC(c3ccn[nH]3)CC2)CCN1.
What is the InChIKey of 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one?
The InChIKey is VDHNDTDBNLIPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c20-13-9-19(8-5-15-13)14(21)10-18-6-2-11(3-7-18)12-1-4-16-17-12/h1,4,11H,2-3,5-10H2,(H,15,20)(H,16,17).
What are the key properties of 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one?
4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one has a molecular weight of 291.35 g/mol, XLogP of -0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetyl]piperazin-2-one is sourced from PubChem (CID 154775681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).