4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide

C15H14N4OS — CID 63375383

IUPAC4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide
SMILESNNc1cc(C(=O)NCc2cccs2)nc2ccccc12
InChIInChI=1S/C15H14N4OS/c16-19-13-8-14(18-12-6-2-1-5-11(12)13)15(20)17-9-10-4-3-7-21-10/h1-8H,9,16H2,(H,17,20)(H,18,19)
InChIKeyMVNHPITYBVMOCP-UHFFFAOYSA-N
MW298.37 g/mol
LogP2.51
Rot. Bonds4

About 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide

4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide (PubChem CID 63375383) has the molecular formula C15H14N4OS and a molecular weight of 298.37 g/mol. Its IUPAC name is 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide
PubChem CID63375383
Molecular FormulaC15H14N4OS
Molecular Weight298.37 g/mol
Exact Mass298.09
IUPAC Name4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide
SMILESNNc1cc(C(=O)NCc2cccs2)nc2ccccc12
InChIInChI=1S/C15H14N4OS/c16-19-13-8-14(18-12-6-2-1-5-11(12)13)15(20)17-9-10-4-3-7-21-10/h1-8H,9,16H2,(H,17,20)(H,18,19)
InChIKeyMVNHPITYBVMOCP-UHFFFAOYSA-N
XLogP2.51
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 52.51
H-Bond Donors ≤ 53
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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Related Compounds

4-hydrazinyl-N-(3,3,3-trifluoropropyl)quinoline-2-carboxamide
CID 63375657
4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide
CID 63375107
4-hydrazinyl-N-(thiolan-3-ylmethyl)quinoline-2-carboxamide
CID 107298266
6-(thiophen-2-ylmethylcarbamoyl)pyridine-2-carboxylic acid
CID 43558368
4-hydrazinyl-N,N-dipropylquinoline-2-carboxamide
CID 63375200
2-(4-chlorophenyl)-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide
CID 4304622
2-(4-bromophenyl)-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide
CID 4182040
4-amino-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 62153900
4-amino-N-(1,3-thiazol-2-ylmethyl)quinoline-2-carboxamide
CID 63375458
2-(5-chlorothiophen-2-yl)-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide
CID 1010569
N-hexan-3-yl-4-hydrazinylquinoline-2-carboxamide
CID 63375019
4-amino-N-[(5-methylthiophen-2-yl)methyl]quinoline-2-carboxamide
CID 63375047

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide?
The IUPAC name of 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide (CID 63375383) is 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide is NNc1cc(C(=O)NCc2cccs2)nc2ccccc12.
What is the InChIKey of 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide?
The InChIKey is MVNHPITYBVMOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4OS/c16-19-13-8-14(18-12-6-2-1-5-11(12)13)15(20)17-9-10-4-3-7-21-10/h1-8H,9,16H2,(H,17,20)(H,18,19).
What are the key properties of 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide?
4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 2.51, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide is sourced from PubChem (CID 63375383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).