[5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone

C20H15N5O — CID 134146580

IUPAC[5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone
SMILESNc1c(C(=O)c2cc3ccccc3[nH]2)cnn1-c1ccc2[nH]ccc2c1
InChIInChI=1S/C20H15N5O/c21-20-15(19(26)18-10-12-3-1-2-4-17(12)24-18)11-23-25(20)14-5-6-16-13(9-14)7-8-22-16/h1-11,22,24H,21H2
InChIKeyOUJBFEXXSMKZDS-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.65
Rot. Bonds3

About [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone

[5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone (PubChem CID 134146580) has the molecular formula C20H15N5O and a molecular weight of 341.37 g/mol. Its IUPAC name is [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone.

Molecular Properties

Compound Name[5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone
PubChem CID134146580
Molecular FormulaC20H15N5O
Molecular Weight341.37 g/mol
Exact Mass341.13
IUPAC Name[5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone
SMILESNc1c(C(=O)c2cc3ccccc3[nH]2)cnn1-c1ccc2[nH]ccc2c1
InChIInChI=1S/C20H15N5O/c21-20-15(19(26)18-10-12-3-1-2-4-17(12)24-18)11-23-25(20)14-5-6-16-13(9-14)7-8-22-16/h1-11,22,24H,21H2
InChIKeyOUJBFEXXSMKZDS-UHFFFAOYSA-N
XLogP3.65
TPSA92.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

Zoligratinib
CID 66555680
1-[[(1S)-1-cyclopropylethyl]amino]-7-(1-methylpyrazol-4-yl)-5H-pyrido[4,3-b]indole-4-carboxamide
CID 42635944
2-(1H-indol-3-yl)-2-oxo-N-(4-pyrazol-1-ylphenyl)acetamide
CID 44596891
1-[[(1R)-1-cyclopropylethyl]amino]-7-(1-methylpyrazol-4-yl)-5H-pyrido[4,3-b]indole-4-carboxamide
CID 42635906
1-(1-cyclopropylpropylamino)-7-(1-methylpyrazol-4-yl)-5H-pyrido[4,3-b]indole-4-carboxamide
CID 42635949
1-[(1-cyclopropyl-2-methylpropyl)amino]-7-(1-methylpyrazol-4-yl)-5H-pyrido[4,3-b]indole-4-carboxamide
CID 42635982
[5-amino-1-(2-methyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-(6-methyl-1H-indol-2-yl)methanone
CID 50939489
2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-(4-pyrazol-1-ylphenyl)acetamide
CID 54771575
[5-amino-1-(2-ethyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone
CID 66555232
[5-amino-1-(2-methyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-(6-phenyl-1H-indol-2-yl)methanone
CID 68005486
[5-amino-1-(2-methyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-[6-[(4,4-difluoropiperidin-1-yl)methyl]-1H-indol-2-yl]methanone
CID 68005621
[5-amino-1-(1H-benzimidazol-6-yl)-1H-pyrazol-4-yl]-1H-indol-2-ylMethanone
CID 68005732

Frequently Asked Questions

What is the IUPAC name of [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone?
The IUPAC name of [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone (CID 134146580) is [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone.
What is the SMILES notation for [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone?
The canonical SMILES for [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone is Nc1c(C(=O)c2cc3ccccc3[nH]2)cnn1-c1ccc2[nH]ccc2c1.
What is the InChIKey of [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone?
The InChIKey is OUJBFEXXSMKZDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O/c21-20-15(19(26)18-10-12-3-1-2-4-17(12)24-18)11-23-25(20)14-5-6-16-13(9-14)7-8-22-16/h1-11,22,24H,21H2.
What are the key properties of [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone?
[5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone has a molecular weight of 341.37 g/mol, XLogP of 3.65, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-amino-1-(1H-indol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone is sourced from PubChem (CID 134146580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).