5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide

C21H24N4O2 — CID 78858995

IUPAC5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)NC(CN3CCOCC3)c3ccccc3)c2c1
InChIInChI=1S/C21H24N4O2/c1-15-7-8-18-17(13-15)20(24-23-18)21(26)22-19(16-5-3-2-4-6-16)14-25-9-11-27-12-10-25/h2-8,13,19H,9-12,14H2,1H3,(H,22,26)(H,23,24)
InChIKeyIOJSFNZTRIFYHI-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.67
Rot. Bonds5

About 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide

5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide (PubChem CID 78858995) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide
PubChem CID78858995
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide
SMILESCc1ccc2[nH]nc(C(=O)NC(CN3CCOCC3)c3ccccc3)c2c1
InChIInChI=1S/C21H24N4O2/c1-15-7-8-18-17(13-15)20(24-23-18)21(26)22-19(16-5-3-2-4-6-16)14-25-9-11-27-12-10-25/h2-8,13,19H,9-12,14H2,1H3,(H,22,26)(H,23,24)
InChIKeyIOJSFNZTRIFYHI-UHFFFAOYSA-N
XLogP2.67
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-5-nitro-1H-indazole-3-carboxamide
CID 39460092
3,5-dimethyl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 25485403
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
(5-methyl-1H-indazol-3-yl)-morpholin-4-ylmethanone
CID 78869833
3-(2,4-dimethylphenyl)-N-(2-morpholin-4-yl-1-phenylethyl)propanamide
CID 24649384
2-(3-methylphenoxy)-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9148983
2-hydroxy-N-(2-morpholin-4-yl-1-phenylethyl)benzamide
CID 86918289
2-(4-methylphenyl)sulfanyl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9149582
6-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-3,4-dihydro-2H-pyran-5-carboxamide
CID 102553631
3-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
CID 24505123
3-methyl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-4-nitrobenzamide
CID 9148512
2-fluoro-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 9149743

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide (CID 78858995) is 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide is Cc1ccc2[nH]nc(C(=O)NC(CN3CCOCC3)c3ccccc3)c2c1.
What is the InChIKey of 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide?
The InChIKey is IOJSFNZTRIFYHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-15-7-8-18-17(13-15)20(24-23-18)21(26)22-19(16-5-3-2-4-6-16)14-25-9-11-27-12-10-25/h2-8,13,19H,9-12,14H2,1H3,(H,22,26)(H,23,24).
What are the key properties of 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide?
5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-morpholin-4-yl-1-phenylethyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 78858995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).