N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide

C12H19N5O2 — CID 61176642

IUPACN-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)NCC(=O)N1CCNCC1
InChIInChI=1S/C12H19N5O2/c18-11(2-7-17-6-1-3-15-17)14-10-12(19)16-8-4-13-5-9-16/h1,3,6,13H,2,4-5,7-10H2,(H,14,18)
InChIKeyODHBVIOVYGVURW-UHFFFAOYSA-N
MW265.32 g/mol
LogP-1.18
Rot. Bonds5

About N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide

N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide (PubChem CID 61176642) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide
PubChem CID61176642
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)NCC(=O)N1CCNCC1
InChIInChI=1S/C12H19N5O2/c18-11(2-7-17-6-1-3-15-17)14-10-12(19)16-8-4-13-5-9-16/h1,3,6,13H,2,4-5,7-10H2,(H,14,18)
InChIKeyODHBVIOVYGVURW-UHFFFAOYSA-N
XLogP-1.18
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-pyrazol-1-yl-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)propanamide
CID 120810613
1-piperazin-1-yl-2-pyrazol-1-ylethanone
CID 23070038
3-[methyl(2-pyrazol-1-ylethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 120982786
1-(4-propanoylpiperazin-1-yl)-3-pyrazol-1-ylpropan-1-one
CID 71934218
1-piperidin-1-yl-3-pyrazol-1-ylpropan-1-one
CID 176931568
2-[methyl(2-pyrazol-1-ylethyl)amino]-1-piperazin-1-ylethanone
CID 54960870
1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyrazol-1-ylpropan-1-one
CID 43501387
1-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-3-pyrazol-1-ylpropan-1-one;dihydrochloride
CID 120658799
N-(5-piperazin-1-yl-2-pyridinyl)-3-pyrazol-1-ylpropanamide
CID 119494267
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 120891919
N-(piperidin-3-ylmethyl)-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 119461176
N-(5-piperazin-1-yl-2-pyridinyl)-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 119494266

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide (CID 61176642) is N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide is O=C(CCn1cccn1)NCC(=O)N1CCNCC1.
What is the InChIKey of N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide?
The InChIKey is ODHBVIOVYGVURW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c18-11(2-7-17-6-1-3-15-17)14-10-12(19)16-8-4-13-5-9-16/h1,3,6,13H,2,4-5,7-10H2,(H,14,18).
What are the key properties of N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide?
N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide has a molecular weight of 265.32 g/mol, XLogP of -1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-piperazin-1-ylethyl)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 61176642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).