3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide

C13H16ClN5O — CID 103011360

IUPAC3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)NCCc2ccnn2C)n1
InChIInChI=1S/C13H16ClN5O/c1-15-11-4-3-10(14)12(18-11)13(20)16-7-5-9-6-8-17-19(9)2/h3-4,6,8H,5,7H2,1-2H3,(H,15,18)(H,16,20)
InChIKeyMENCADSKMFSUBY-UHFFFAOYSA-N
MW293.76 g/mol
LogP1.48
Rot. Bonds5

About 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide

3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide (PubChem CID 103011360) has the molecular formula C13H16ClN5O and a molecular weight of 293.76 g/mol. Its IUPAC name is 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
PubChem CID103011360
Molecular FormulaC13H16ClN5O
Molecular Weight293.76 g/mol
Exact Mass293.10
IUPAC Name3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)NCCc2ccnn2C)n1
InChIInChI=1S/C13H16ClN5O/c1-15-11-4-3-10(14)12(18-11)13(20)16-7-5-9-6-8-17-19(9)2/h3-4,6,8H,5,7H2,1-2H3,(H,15,18)(H,16,20)
InChIKeyMENCADSKMFSUBY-UHFFFAOYSA-N
XLogP1.48
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.76
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-6-(methylamino)-N-[(2-methylpyrazol-3-yl)methyl]pyridine-2-carboxamide
CID 55206512
N-(2-acetamidoethyl)-3-chloro-6-(methylamino)pyridine-2-carboxamide
CID 62170062
5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]-1,3,4-thiadiazole-2-carboxamide
CID 103005665
3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
CID 106422909
5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]furan-2-carboxamide
CID 104693705
1-methyl-3-[2-(2-methylpyrazol-3-yl)ethyl]urea
CID 104693382
6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide
CID 103005660
3-chloro-N-[2-(2-methoxyethoxy)ethyl]-6-(methylamino)pyridine-2-carboxamide
CID 62179799
2-amino-6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-4-carboxamide
CID 104694768
3,4,5-trifluoro-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 104693722
3-chloro-6-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-2-carboxamide
CID 79231418
5-bromo-N-[2-(2-methylpyrazol-3-yl)ethyl]thiophene-2-carboxamide
CID 104693703

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide (CID 103011360) is 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide is CNc1ccc(Cl)c(C(=O)NCCc2ccnn2C)n1.
What is the InChIKey of 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is MENCADSKMFSUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN5O/c1-15-11-4-3-10(14)12(18-11)13(20)16-7-5-9-6-8-17-19(9)2/h3-4,6,8H,5,7H2,1-2H3,(H,15,18)(H,16,20).
What are the key properties of 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide?
3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 293.76 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 103011360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).