1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide

C22H19N7O — CID 97447388

IUPAC1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
SMILESCn1cc(-c2ccc3ccc(-n4ccc(C(=O)NCc5ccccn5)n4)n3c2)cn1
InChIInChI=1S/C22H19N7O/c1-27-14-17(12-25-27)16-5-6-19-7-8-21(28(19)15-16)29-11-9-20(26-29)22(30)24-13-18-4-2-3-10-23-18/h2-12,14-15H,13H2,1H3,(H,24,30)
InChIKeyFTRZMYNCXNCAQU-UHFFFAOYSA-N
MW397.44 g/mol
LogP2.85
Rot. Bonds5

About 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide

1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide (PubChem CID 97447388) has the molecular formula C22H19N7O and a molecular weight of 397.44 g/mol. Its IUPAC name is 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
PubChem CID97447388
Molecular FormulaC22H19N7O
Molecular Weight397.44 g/mol
Exact Mass397.17
IUPAC Name1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
SMILESCn1cc(-c2ccc3ccc(-n4ccc(C(=O)NCc5ccccn5)n4)n3c2)cn1
InChIInChI=1S/C22H19N7O/c1-27-14-17(12-25-27)16-5-6-19-7-8-21(28(19)15-16)29-11-9-20(26-29)22(30)24-13-18-4-2-3-10-23-18/h2-12,14-15H,13H2,1H3,(H,24,30)
InChIKeyFTRZMYNCXNCAQU-UHFFFAOYSA-N
XLogP2.85
TPSA82.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.44
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-1-(6-pyridin-4-ylindolizin-3-yl)-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
CID 97407502
1-[6-(3-fluorophenyl)indolizin-3-yl]-N-[(5-methylpyrazin-2-yl)methyl]pyrazole-3-carboxamide
CID 97447409
N-[2-(dimethylamino)ethyl]-1-(6-pyridin-4-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97447361
3-(4-acetylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)indolizine-6-carboxamide
CID 97447967
1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide
CID 97362166
1-cyclopentyl-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
CID 35762704
2-amino-2-(1-methylpyrazol-4-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 115289633
6-(4-methoxy-3,5-dimethylphenyl)-N-(pyridin-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42690204
N-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]methyl]-2-phenyltriazole-4-carboxamide
CID 122245887
N-[(5-methylpyrazin-2-yl)methyl]-2-(6-pyridin-3-ylindolizin-3-yl)pyrazole-3-carboxamide
CID 97362006
3-(difluoromethyl)-1-methyl-N-(pyridin-2-ylmethyl)pyrazole-4-carboxamide
CID 154582530
1,3-dimethyl-2,4-dioxo-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide
CID 84557714

Frequently Asked Questions

What is the IUPAC name of 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide?
The IUPAC name of 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide (CID 97447388) is 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide is Cn1cc(-c2ccc3ccc(-n4ccc(C(=O)NCc5ccccn5)n4)n3c2)cn1.
What is the InChIKey of 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide?
The InChIKey is FTRZMYNCXNCAQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N7O/c1-27-14-17(12-25-27)16-5-6-19-7-8-21(28(19)15-16)29-11-9-20(26-29)22(30)24-13-18-4-2-3-10-23-18/h2-12,14-15H,13H2,1H3,(H,24,30).
What are the key properties of 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide?
1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide has a molecular weight of 397.44 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(1-methylpyrazol-4-yl)indolizin-3-yl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 97447388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).