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

C21H23N5O3 — CID 46226282

IUPAC2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCOCC4)cc3)nc12
InChIInChI=1S/C21H23N5O3/c22-20(27)18-3-1-2-16-14-26(24-19(16)18)17-6-4-15(5-7-17)21(28)23-8-9-25-10-12-29-13-11-25/h1-7,14H,8-13H2,(H2,22,27)(H,23,28)
InChIKeyPOINJFUROGHWOY-UHFFFAOYSA-N
MW393.45 g/mol
LogP1.19
Rot. Bonds6

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

2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide (PubChem CID 46226282) has the molecular formula C21H23N5O3 and a molecular weight of 393.45 g/mol. Its IUPAC name is 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide.

Molecular Properties

Compound Name2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
PubChem CID46226282
Molecular FormulaC21H23N5O3
Molecular Weight393.45 g/mol
Exact Mass393.18
IUPAC Name2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCOCC4)cc3)nc12
InChIInChI=1S/C21H23N5O3/c22-20(27)18-3-1-2-16-14-26(24-19(16)18)17-6-4-15(5-7-17)21(28)23-8-9-25-10-12-29-13-11-25/h1-7,14H,8-13H2,(H2,22,27)(H,23,28)
InChIKeyPOINJFUROGHWOY-UHFFFAOYSA-N
XLogP1.19
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.45
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Niraparib
CID 24958200
2-(4-(piperidin-3-yl)phenyl)-2H-indazole-7-carboxamide
CID 24958198
2-phenyl-2H-indazole-7-carboxamide
CID 44549251
Epz005687
CID 60160561
3-(5-(morpholinomethyl)-1H-indol-2-yl)-6-(1H-pyrazol-4-yl)quinolin-2(1H)-one
CID 44419980
c-Niraparib
CID 124081212
4-(5-methylpyrazol-1-yl)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 9266746
N-[4-(morpholin-4-ylmethyl)phenyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 5309237
N-[2-(morpholin-4-yl)ethyl]-1,3-diphenyl-1H-pyrazole-4-carboxamide
CID 17469911
N-(1-benzylpiperidin-4-yl)-1H-indazole-5-carboxamide
CID 22933917
3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-1-phenylpyrazole-4-carboxamide
CID 24244888
(R)-2-(4-(piperidin-3-yl)phenyl)-2H-indazole-7-carboxamide
CID 24958199

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The IUPAC name of 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide (CID 46226282) is 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide.
What is the SMILES notation for 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The canonical SMILES for 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCOCC4)cc3)nc12.
What is the InChIKey of 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The InChIKey is POINJFUROGHWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O3/c22-20(27)18-3-1-2-16-14-26(24-19(16)18)17-6-4-15(5-7-17)21(28)23-8-9-25-10-12-29-13-11-25/h1-7,14H,8-13H2,(H2,22,27)(H,23,28).
What are the key properties of 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide has a molecular weight of 393.45 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazole-7-carboxamide is sourced from PubChem (CID 46226282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).