N'-(2-methylbenzoyl)piperidine-4-carbohydrazide

C14H19N3O2 — CID 82121687

IUPACN'-(2-methylbenzoyl)piperidine-4-carbohydrazide
SMILESCc1ccccc1C(=O)NNC(=O)C1CCNCC1
InChIInChI=1S/C14H19N3O2/c1-10-4-2-3-5-12(10)14(19)17-16-13(18)11-6-8-15-9-7-11/h2-5,11,15H,6-9H2,1H3,(H,16,18)(H,17,19)
InChIKeyYUFNETHULUAPSP-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.76
Rot. Bonds2

About N'-(2-methylbenzoyl)piperidine-4-carbohydrazide

N'-(2-methylbenzoyl)piperidine-4-carbohydrazide (PubChem CID 82121687) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N'-(2-methylbenzoyl)piperidine-4-carbohydrazide.

Molecular Properties

Compound NameN'-(2-methylbenzoyl)piperidine-4-carbohydrazide
PubChem CID82121687
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN'-(2-methylbenzoyl)piperidine-4-carbohydrazide
SMILESCc1ccccc1C(=O)NNC(=O)C1CCNCC1
InChIInChI=1S/C14H19N3O2/c1-10-4-2-3-5-12(10)14(19)17-16-13(18)11-6-8-15-9-7-11/h2-5,11,15H,6-9H2,1H3,(H,16,18)(H,17,19)
InChIKeyYUFNETHULUAPSP-UHFFFAOYSA-N
XLogP0.76
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-methylbenzoyl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbohydrazide
CID 55349850
N-[2-[2-(cyclopropanecarbonyl)hydrazinyl]-2-oxoethyl]-2-methylbenzamide
CID 51165990
2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide
CID 47102090
(1S)-2-[[(2-methylbenzoyl)amino]carbamoyl]cyclohexane-1-carboxylic acid
CID 46738364
N'-(2-methylbenzoyl)oxolane-2-carbohydrazide
CID 51164592
N-[2-(ethylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 119284316
1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N'-(2-methylbenzoyl)piperidine-4-carbohydrazide
CID 46807195
N'-(2-phenylacetyl)piperidine-4-carbohydrazide
CID 82121690
N'-(cyclopropanecarbonyl)-2-methylsulfanylbenzohydrazide
CID 26798777
N-[3-(cyclopropanecarbonylamino)phenyl]-2-methylbenzamide
CID 39991684
2-methyl-N-[(3R,4R)-3-methylpiperidin-4-yl]benzamide
CID 124516930
N'-(2-methylbenzoyl)-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carbohydrazide
CID 43057127

Frequently Asked Questions

What is the IUPAC name of N'-(2-methylbenzoyl)piperidine-4-carbohydrazide?
The IUPAC name of N'-(2-methylbenzoyl)piperidine-4-carbohydrazide (CID 82121687) is N'-(2-methylbenzoyl)piperidine-4-carbohydrazide.
What is the SMILES notation for N'-(2-methylbenzoyl)piperidine-4-carbohydrazide?
The canonical SMILES for N'-(2-methylbenzoyl)piperidine-4-carbohydrazide is Cc1ccccc1C(=O)NNC(=O)C1CCNCC1.
What is the InChIKey of N'-(2-methylbenzoyl)piperidine-4-carbohydrazide?
The InChIKey is YUFNETHULUAPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10-4-2-3-5-12(10)14(19)17-16-13(18)11-6-8-15-9-7-11/h2-5,11,15H,6-9H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N'-(2-methylbenzoyl)piperidine-4-carbohydrazide?
N'-(2-methylbenzoyl)piperidine-4-carbohydrazide has a molecular weight of 261.32 g/mol, XLogP of 0.76, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylbenzoyl)piperidine-4-carbohydrazide is sourced from PubChem (CID 82121687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).