6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide

C19H22N6O — CID 143507222

IUPAC6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide
SMILESCn1nc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)c2ccccc21
InChIInChI=1S/C19H22N6O/c1-23-17-5-3-2-4-15(17)16(22-23)13-24-8-10-25(11-9-24)18-7-6-14(12-21-18)19(20)26/h2-7,12H,8-11,13H2,1H3,(H2,20,26)
InChIKeyBKVUMOCDWFODCB-UHFFFAOYSA-N
MW350.43 g/mol
LogP1.39
Rot. Bonds4

About 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide

6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide (PubChem CID 143507222) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide
PubChem CID143507222
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide
SMILESCn1nc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)c2ccccc21
InChIInChI=1S/C19H22N6O/c1-23-17-5-3-2-4-15(17)16(22-23)13-24-8-10-25(11-9-24)18-7-6-14(12-21-18)19(20)26/h2-7,12H,8-11,13H2,1H3,(H2,20,26)
InChIKeyBKVUMOCDWFODCB-UHFFFAOYSA-N
XLogP1.39
TPSA80.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide?
The IUPAC name of 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide (CID 143507222) is 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide is Cn1nc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)c2ccccc21.
What is the InChIKey of 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide?
The InChIKey is BKVUMOCDWFODCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-23-17-5-3-2-4-15(17)16(22-23)13-24-8-10-25(11-9-24)18-7-6-14(12-21-18)19(20)26/h2-7,12H,8-11,13H2,1H3,(H2,20,26).
What are the key properties of 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide?
6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide has a molecular weight of 350.43 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(1-methylindazol-3-yl)methyl]piperazin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 143507222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).