N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide

C14H16N4OS — CID 62242780

IUPACN-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
SMILESNNc1cc(C(=O)N(Cc2cccs2)C2CC2)ccn1
InChIInChI=1S/C14H16N4OS/c15-17-13-8-10(5-6-16-13)14(19)18(11-3-4-11)9-12-2-1-7-20-12/h1-2,5-8,11H,3-4,9,15H2,(H,16,17)
InChIKeyYQJGKHOFURABNO-UHFFFAOYSA-N
MW288.38 g/mol
LogP2.23
Rot. Bonds5

About N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide

N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 62242780) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
PubChem CID62242780
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC NameN-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
SMILESNNc1cc(C(=O)N(Cc2cccs2)C2CC2)ccn1
InChIInChI=1S/C14H16N4OS/c15-17-13-8-10(5-6-16-13)14(19)18(11-3-4-11)9-12-2-1-7-20-12/h1-2,5-8,11H,3-4,9,15H2,(H,16,17)
InChIKeyYQJGKHOFURABNO-UHFFFAOYSA-N
XLogP2.23
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide (CID 62242780) is N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide is NNc1cc(C(=O)N(Cc2cccs2)C2CC2)ccn1.
What is the InChIKey of N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is YQJGKHOFURABNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c15-17-13-8-10(5-6-16-13)14(19)18(11-3-4-11)9-12-2-1-7-20-12/h1-2,5-8,11H,3-4,9,15H2,(H,16,17).
What are the key properties of N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide has a molecular weight of 288.38 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 62242780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).