2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide

C10H17N5O — CID 61283155

IUPAC2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide
SMILESO=C(CN1CCNCC1)NCc1ccn[nH]1
InChIInChI=1S/C10H17N5O/c16-10(8-15-5-3-11-4-6-15)12-7-9-1-2-13-14-9/h1-2,11H,3-8H2,(H,12,16)(H,13,14)
InChIKeyVLVLMZLMGWVVDL-UHFFFAOYSA-N
MW223.28 g/mol
LogP-1.07
Rot. Bonds4

About 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide

2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide (PubChem CID 61283155) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide.

Molecular Properties

Compound Name2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide
PubChem CID61283155
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide
SMILESO=C(CN1CCNCC1)NCc1ccn[nH]1
InChIInChI=1S/C10H17N5O/c16-10(8-15-5-3-11-4-6-15)12-7-9-1-2-13-14-9/h1-2,11H,3-8H2,(H,12,16)(H,13,14)
InChIKeyVLVLMZLMGWVVDL-UHFFFAOYSA-N
XLogP-1.07
TPSA73.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 141430312
2-piperazin-1-yl-N-(pyridazin-3-ylmethyl)acetamide
CID 106896052
3-oxo-3-(1H-pyrazol-5-ylmethylamino)propanoic acid
CID 62232296
2-(3-amino-1,2,4-triazol-1-yl)-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 61284266
2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide
CID 54943649
2-cyano-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 131084161
N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide
CID 62995583
2-(1,4-diazepan-1-yl)-N-[(4-hydroxyphenyl)methyl]acetamide
CID 114332159
2-piperazin-1-yl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 62880126
2-(1,4-diazepan-1-yl)-N-(1H-imidazol-2-ylmethyl)acetamide
CID 64530362
6-oxo-6-(1H-pyrazol-5-ylmethylamino)hexanoic acid
CID 61286078
N-(phenanthridin-6-ylmethyl)-2-(1,4,7,10-tetrazacyclododec-1-yl)acetamide
CID 90006117

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide?
The IUPAC name of 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide (CID 61283155) is 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide.
What is the SMILES notation for 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide?
The canonical SMILES for 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide is O=C(CN1CCNCC1)NCc1ccn[nH]1.
What is the InChIKey of 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide?
The InChIKey is VLVLMZLMGWVVDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c16-10(8-15-5-3-11-4-6-15)12-7-9-1-2-13-14-9/h1-2,11H,3-8H2,(H,12,16)(H,13,14).
What are the key properties of 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide?
2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide has a molecular weight of 223.28 g/mol, XLogP of -1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-N-(1H-pyrazol-5-ylmethyl)acetamide is sourced from PubChem (CID 61283155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).