N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide

C14H20N4O2 — CID 65449993

IUPACN'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide
SMILESCC1CN(CC(=O)NNC(=O)c2ccccc2)CCN1
InChIInChI=1S/C14H20N4O2/c1-11-9-18(8-7-15-11)10-13(19)16-17-14(20)12-5-3-2-4-6-12/h2-6,11,15H,7-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyJIKXUIDCEGJNIJ-UHFFFAOYSA-N
MW276.34 g/mol
LogP-0.26
Rot. Bonds3

About N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide

N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide (PubChem CID 65449993) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide.

Molecular Properties

Compound NameN'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide
PubChem CID65449993
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide
SMILESCC1CN(CC(=O)NNC(=O)c2ccccc2)CCN1
InChIInChI=1S/C14H20N4O2/c1-11-9-18(8-7-15-11)10-13(19)16-17-14(20)12-5-3-2-4-6-12/h2-6,11,15H,7-10H2,1H3,(H,16,19)(H,17,20)
InChIKeyJIKXUIDCEGJNIJ-UHFFFAOYSA-N
XLogP-0.26
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(3R)-3-methylpiperazin-1-yl]acetyl]benzamide
CID 104975759
N-benzyl-2-[(3S)-3-methylpiperazin-1-yl]acetamide
CID 104976872
N'-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]acetyl]benzohydrazide
CID 8898901
N'-[2-(3-hydroxypyrrolidin-1-yl)acetyl]benzohydrazide
CID 62916316
2-(3-methylpiperazin-1-yl)-N-(1-phenylethyl)acetamide
CID 65448844
N'-[2-(3-aminopiperidin-1-yl)acetyl]benzohydrazide
CID 61295576
2-(3-methylpiperazin-1-yl)-N-(3-phenylpropyl)acetamide
CID 65449797
N-(2-chlorophenyl)-2-(3-methylpiperazin-1-yl)acetamide
CID 65450158
N'-(2-morpholin-4-ylacetyl)benzohydrazide
CID 8903734
N'-[2-[4-(2-hydroxyethyl)piperazin-1-yl]acetyl]benzohydrazide
CID 78787526
N-(4-fluorophenyl)-2-[(3R)-3-methylpiperazin-1-yl]acetamide
CID 104975542
2-(3-methylpiperazin-1-yl)-N-pyrimidin-2-ylacetamide
CID 65450346

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide?
The IUPAC name of N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide (CID 65449993) is N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide.
What is the SMILES notation for N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide?
The canonical SMILES for N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide is CC1CN(CC(=O)NNC(=O)c2ccccc2)CCN1.
What is the InChIKey of N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide?
The InChIKey is JIKXUIDCEGJNIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-11-9-18(8-7-15-11)10-13(19)16-17-14(20)12-5-3-2-4-6-12/h2-6,11,15H,7-10H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide?
N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide has a molecular weight of 276.34 g/mol, XLogP of -0.26, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-methylpiperazin-1-yl)acetyl]benzohydrazide is sourced from PubChem (CID 65449993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).