2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide

C21H23N5O2 — CID 46226265

IUPAC2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCCC4)cc3)nc12
InChIInChI=1S/C21H23N5O2/c22-20(27)18-5-3-4-16-14-26(24-19(16)18)17-8-6-15(7-9-17)21(28)23-10-13-25-11-1-2-12-25/h3-9,14H,1-2,10-13H2,(H2,22,27)(H,23,28)
InChIKeyJYIUENDUXWJYGO-UHFFFAOYSA-N
MW377.45 g/mol
LogP1.95
Rot. Bonds6

About 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide

2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide (PubChem CID 46226265) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide.

Molecular Properties

Compound Name2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
PubChem CID46226265
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC Name2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCCC4)cc3)nc12
InChIInChI=1S/C21H23N5O2/c22-20(27)18-5-3-4-16-14-26(24-19(16)18)17-8-6-15(7-9-17)21(28)23-10-13-25-11-1-2-12-25/h3-9,14H,1-2,10-13H2,(H2,22,27)(H,23,28)
InChIKeyJYIUENDUXWJYGO-UHFFFAOYSA-N
XLogP1.95
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Niraparib
CID 24958200
2-(4-(piperidin-3-yl)phenyl)-2H-indazole-7-carboxamide
CID 24958198
3-[5-(Piperidin-1-Ylmethyl)-1h-Indol-2-Yl]-6-(1h-Pyrazol-4-Yl)quinolin-2(1h)-One
CID 11690363
Dihydropyrrolopyrazole, 9
CID 10203646
2-phenyl-2H-indazole-7-carboxamide
CID 44549251
2-Benzyl-2H-indazole-7-carboxamide
CID 44549372
N-(3,4-difluorophenyl)-1-methylindazole-5-carboxamide
CID 77844720
2-(1H-indol-3-yl)-2-oxo-N-(4-pyrazol-1-ylphenyl)acetamide
CID 44596891
N-ethyl-5-methyl-N-[2-[3-(6-methyl-2-pyridinyl)pyrazol-1-yl]ethyl]-2-(triazol-2-yl)benzamide
CID 57389484
N-ethyl-N-[2-[3-(4-fluorophenyl)pyrazol-1-yl]ethyl]-5-methyl-2-(triazol-2-yl)benzamide
CID 57389971
N-[2-methyl-5-[[2-(4-methylpiperazin-1-yl)phenyl]methylcarbamoyl]-3-pyridinyl]-6-(2-methylpyrazol-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 71283495
1-(4-fluoro-1H-indol-3-yl)-2-[4-(1H-pyrazole-3-carbonyl)piperazin-1-yl]ethane-1,2-dione
CID 506360

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The IUPAC name of 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide (CID 46226265) is 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide.
What is the SMILES notation for 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The canonical SMILES for 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCCC4)cc3)nc12.
What is the InChIKey of 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The InChIKey is JYIUENDUXWJYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c22-20(27)18-5-3-4-16-14-26(24-19(16)18)17-8-6-15(7-9-17)21(28)23-10-13-25-11-1-2-12-25/h3-9,14H,1-2,10-13H2,(H2,22,27)(H,23,28).
What are the key properties of 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide is sourced from PubChem (CID 46226265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).