5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide

C13H15ClN4O2 — CID 62249621

IUPAC5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2cnc(NN)c(Cl)c2)o1
InChIInChI=1S/C13H15ClN4O2/c1-7-3-4-11(20-7)8(2)17-13(19)9-5-10(14)12(18-15)16-6-9/h3-6,8H,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyXPXMKDCEQPCPRU-UHFFFAOYSA-N
MW294.74 g/mol
LogP2.41
Rot. Bonds4

About 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide

5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide (PubChem CID 62249621) has the molecular formula C13H15ClN4O2 and a molecular weight of 294.74 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
PubChem CID62249621
Molecular FormulaC13H15ClN4O2
Molecular Weight294.74 g/mol
Exact Mass294.09
IUPAC Name5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2cnc(NN)c(Cl)c2)o1
InChIInChI=1S/C13H15ClN4O2/c1-7-3-4-11(20-7)8(2)17-13(19)9-5-10(14)12(18-15)16-6-9/h3-6,8H,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyXPXMKDCEQPCPRU-UHFFFAOYSA-N
XLogP2.41
TPSA93.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.74
LogP ≤ 52.41
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

5-chloro-N-[1-(2-chlorophenyl)ethyl]-6-hydrazinylpyridine-3-carboxamide
CID 62247507
5-chloro-6-hydrazinyl-N-(3-methylbutan-2-yl)pyridine-3-carboxamide
CID 62243839
N-[1-(3-bromophenyl)ethyl]-5-chloro-6-hydrazinylpyridine-3-carboxamide
CID 62237377
6-fluoro-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 63977964
5-chloro-6-hydrazinyl-N-pentan-3-ylpyridine-3-carboxamide
CID 62247358
5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
CID 63722692
3,5-difluoro-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 46443441
3-amino-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 43703392
2-chloro-N-[1-(5-methylfuran-2-yl)ethyl]-5-methylsulfanylbenzamide
CID 47110574
5-chloro-6-(methylamino)-N-[1-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62176085
3,4-dimethoxy-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 46494747
4-hydroxy-3-methyl-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 103951699

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide (CID 62249621) is 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide is Cc1ccc(C(C)NC(=O)c2cnc(NN)c(Cl)c2)o1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is XPXMKDCEQPCPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O2/c1-7-3-4-11(20-7)8(2)17-13(19)9-5-10(14)12(18-15)16-6-9/h3-6,8H,15H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 294.74 g/mol, XLogP of 2.41, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 62249621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).