N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide

C14H14N4O3 — CID 6295838

IUPACN-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide
SMILESC/C(=N/NC(=O)CNC(=O)c1cccnc1)c1ccco1
InChIInChI=1S/C14H14N4O3/c1-10(12-5-3-7-21-12)17-18-13(19)9-16-14(20)11-4-2-6-15-8-11/h2-8H,9H2,1H3,(H,16,20)(H,18,19)/b17-10-
InChIKeyMFCOAAIWLLATTA-YVLHZVERSA-N
MW286.29 g/mol
LogP0.94
Rot. Bonds5

About N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide

N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide (PubChem CID 6295838) has the molecular formula C14H14N4O3 and a molecular weight of 286.29 g/mol. Its IUPAC name is N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide
PubChem CID6295838
Molecular FormulaC14H14N4O3
Molecular Weight286.29 g/mol
Exact Mass286.11
IUPAC NameN-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide
SMILESC/C(=N/NC(=O)CNC(=O)c1cccnc1)c1ccco1
InChIInChI=1S/C14H14N4O3/c1-10(12-5-3-7-21-12)17-18-13(19)9-16-14(20)11-4-2-6-15-8-11/h2-8H,9H2,1H3,(H,16,20)(H,18,19)/b17-10-
InChIKeyMFCOAAIWLLATTA-YVLHZVERSA-N
XLogP0.94
TPSA96.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide (CID 6295838) is N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide is C/C(=N/NC(=O)CNC(=O)c1cccnc1)c1ccco1.
What is the InChIKey of N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide?
The InChIKey is MFCOAAIWLLATTA-YVLHZVERSA-N. The full InChI is InChI=1S/C14H14N4O3/c1-10(12-5-3-7-21-12)17-18-13(19)9-16-14(20)11-4-2-6-15-8-11/h2-8H,9H2,1H3,(H,16,20)(H,18,19)/b17-10-.
What are the key properties of N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide?
N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide has a molecular weight of 286.29 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]pyridine-3-carboxamide is sourced from PubChem (CID 6295838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).