N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide

C18H19N3O4S — CID 46556792

IUPACN'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide
SMILESO=C(NNC(=O)C1CCCN(C(=O)c2cccs2)C1)c1ccccc1O
InChIInChI=1S/C18H19N3O4S/c22-14-7-2-1-6-13(14)17(24)20-19-16(23)12-5-3-9-21(11-12)18(25)15-8-4-10-26-15/h1-2,4,6-8,10,12,22H,3,5,9,11H2,(H,19,23)(H,20,24)
InChIKeyAMFMOPMPIKTVLA-UHFFFAOYSA-N
MW373.43 g/mol
LogP1.77
Rot. Bonds3

About N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide

N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide (PubChem CID 46556792) has the molecular formula C18H19N3O4S and a molecular weight of 373.43 g/mol. Its IUPAC name is N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide
PubChem CID46556792
Molecular FormulaC18H19N3O4S
Molecular Weight373.43 g/mol
Exact Mass373.11
IUPAC NameN'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide
SMILESO=C(NNC(=O)C1CCCN(C(=O)c2cccs2)C1)c1ccccc1O
InChIInChI=1S/C18H19N3O4S/c22-14-7-2-1-6-13(14)17(24)20-19-16(23)12-5-3-9-21(11-12)18(25)15-8-4-10-26-15/h1-2,4,6-8,10,12,22H,3,5,9,11H2,(H,19,23)(H,20,24)
InChIKeyAMFMOPMPIKTVLA-UHFFFAOYSA-N
XLogP1.77
TPSA98.74 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.43
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(propan-2-ylcarbamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55672694
N'-(4-bromo-1H-pyrrole-2-carbonyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide
CID 55559155
(3S)-1-(thiophene-2-carbonyl)-N'-[2-(trifluoromethyl)phenyl]piperidine-3-carbohydrazide
CID 39982573
(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 43057486
N-(2-iodophenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55559011
(3S)-N-propyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 39977852
ethyl 3-[[(2-hydroxybenzoyl)amino]carbamoyl]piperidine-1-carboxylate
CID 43057131
(3R)-N-pyridin-2-yl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 30784713
N-pyridin-2-yl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 43053443
N-[2-methyl-3-(methylcarbamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 46461736
(3S)-N-[(1R,2R)-2-methylcyclohexyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 124743110

Frequently Asked Questions

What is the IUPAC name of N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide?
The IUPAC name of N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide (CID 46556792) is N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide.
What is the SMILES notation for N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide?
The canonical SMILES for N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide is O=C(NNC(=O)C1CCCN(C(=O)c2cccs2)C1)c1ccccc1O.
What is the InChIKey of N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide?
The InChIKey is AMFMOPMPIKTVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4S/c22-14-7-2-1-6-13(14)17(24)20-19-16(23)12-5-3-9-21(11-12)18(25)15-8-4-10-26-15/h1-2,4,6-8,10,12,22H,3,5,9,11H2,(H,19,23)(H,20,24).
What are the key properties of N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide?
N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide has a molecular weight of 373.43 g/mol, XLogP of 1.77, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-hydroxybenzoyl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide is sourced from PubChem (CID 46556792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).