5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide

C19H23N5O2 — CID 135894383

IUPAC5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
SMILESCn1nc(C(=O)NCCN2CCOCC2)cc1-c1cc2ccccc2[nH]1
InChIInChI=1S/C19H23N5O2/c1-23-18(16-12-14-4-2-3-5-15(14)21-16)13-17(22-23)19(25)20-6-7-24-8-10-26-11-9-24/h2-5,12-13,21H,6-11H2,1H3,(H,20,25)
InChIKeyCHZZCIFHGCVGHR-UHFFFAOYSA-N
MW353.43 g/mol
LogP1.63
Rot. Bonds5

About 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide

5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide (PubChem CID 135894383) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
PubChem CID135894383
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
SMILESCn1nc(C(=O)NCCN2CCOCC2)cc1-c1cc2ccccc2[nH]1
InChIInChI=1S/C19H23N5O2/c1-23-18(16-12-14-4-2-3-5-15(14)21-16)13-17(22-23)19(25)20-6-7-24-8-10-26-11-9-24/h2-5,12-13,21H,6-11H2,1H3,(H,20,25)
InChIKeyCHZZCIFHGCVGHR-UHFFFAOYSA-N
XLogP1.63
TPSA75.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The IUPAC name of 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide (CID 135894383) is 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The canonical SMILES for 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide is Cn1nc(C(=O)NCCN2CCOCC2)cc1-c1cc2ccccc2[nH]1.
What is the InChIKey of 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The InChIKey is CHZZCIFHGCVGHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-23-18(16-12-14-4-2-3-5-15(14)21-16)13-17(22-23)19(25)20-6-7-24-8-10-26-11-9-24/h2-5,12-13,21H,6-11H2,1H3,(H,20,25).
What are the key properties of 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indol-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 135894383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).