5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide

C13H14ClN5O2 — CID 62989408

IUPAC5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2cnc(NN)c(Cl)c2)ccn1
InChIInChI=1S/C13H14ClN5O2/c1-21-11-4-8(2-3-16-11)6-18-13(20)9-5-10(14)12(19-15)17-7-9/h2-5,7H,6,15H2,1H3,(H,17,19)(H,18,20)
InChIKeyPEYJHTFWOPENLE-UHFFFAOYSA-N
MW307.74 g/mol
LogP1.35
Rot. Bonds5

About 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide

5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide (PubChem CID 62989408) has the molecular formula C13H14ClN5O2 and a molecular weight of 307.74 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
PubChem CID62989408
Molecular FormulaC13H14ClN5O2
Molecular Weight307.74 g/mol
Exact Mass307.08
IUPAC Name5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2cnc(NN)c(Cl)c2)ccn1
InChIInChI=1S/C13H14ClN5O2/c1-21-11-4-8(2-3-16-11)6-18-13(20)9-5-10(14)12(19-15)17-7-9/h2-5,7H,6,15H2,1H3,(H,17,19)(H,18,20)
InChIKeyPEYJHTFWOPENLE-UHFFFAOYSA-N
XLogP1.35
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.74
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62990773
4-amino-3,5-dichloro-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 82783281
6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62073001
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
5-chloro-6-hydrazinyl-N-[(3-methyl-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 114701879
3-amino-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62072661
5-chloro-N-[(4-cyanophenyl)methyl]-6-hydrazinylpyridine-3-carboxamide
CID 62269659
5-chloro-N-[(4-methoxyphenyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62172418
5-(ethylamino)-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-2-carboxamide
CID 104641230
4-(ethylamino)-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62991671
2-(2,6-dichlorophenyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 18167318
3-fluoro-2-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62989936

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide (CID 62989408) is 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide is COc1cc(CNC(=O)c2cnc(NN)c(Cl)c2)ccn1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
The InChIKey is PEYJHTFWOPENLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN5O2/c1-21-11-4-8(2-3-16-11)6-18-13(20)9-5-10(14)12(19-15)17-7-9/h2-5,7H,6,15H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide has a molecular weight of 307.74 g/mol, XLogP of 1.35, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 62989408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).