2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide

C20H19N5O — CID 95906025

IUPAC2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide
SMILESC[C@@H](NC(=O)Cn1ncc2ccccc21)c1cccc(-n2cccn2)c1
InChIInChI=1S/C20H19N5O/c1-15(16-7-4-8-18(12-16)24-11-5-10-21-24)23-20(26)14-25-19-9-3-2-6-17(19)13-22-25/h2-13,15H,14H2,1H3,(H,23,26)/t15-/m1/s1
InChIKeyRYPXMNAFGKESIZ-OAHLLOKOSA-N
MW345.41 g/mol
LogP3.10
Rot. Bonds5

About 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide

2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide (PubChem CID 95906025) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide
PubChem CID95906025
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide
SMILESC[C@@H](NC(=O)Cn1ncc2ccccc21)c1cccc(-n2cccn2)c1
InChIInChI=1S/C20H19N5O/c1-15(16-7-4-8-18(12-16)24-11-5-10-21-24)23-20(26)14-25-19-9-3-2-6-17(19)13-22-25/h2-13,15H,14H2,1H3,(H,23,26)/t15-/m1/s1
InChIKeyRYPXMNAFGKESIZ-OAHLLOKOSA-N
XLogP3.10
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-indazol-1-yl-N-[(1S)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide
CID 95906024
N-[1-(3-pyrazol-1-ylphenyl)ethyl]acetamide
CID 175743985
N-[(1S)-1-(3-pyrazol-1-ylphenyl)ethyl]-3-pyridin-2-ylpropanamide
CID 95906018
3,3-dimethyl-5-oxo-5-[1-(3-pyrazol-1-ylphenyl)ethylamino]pentanoic acid
CID 119139749
3-(4-methylpyrazol-1-yl)-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]propanamide
CID 95906003
(2S)-2-[(2-indazol-1-ylacetyl)amino]propanoic acid
CID 119238085
3-amino-2-methyl-N-[1-(3-pyrazol-1-ylphenyl)ethyl]butanamide
CID 120501001
(2R)-2-methylsulfanyl-N-[(1S)-1-(3-pyrazol-1-ylphenyl)ethyl]propanamide
CID 95933671
N-[(1S)-1-(3-pyrazol-1-ylphenyl)ethyl]-3-(1,3-thiazol-4-yl)propanamide
CID 95906052
3-piperidin-3-yl-N-[1-(3-pyrazol-1-ylphenyl)ethyl]butanamide
CID 119788718
N-methyl-1-(3-pyrazol-1-ylphenyl)ethanamine
CID 16640542
methyl (2R)-2-[(2-indazol-1-ylacetyl)amino]-3-methoxypropanoate
CID 97260617

Frequently Asked Questions

What is the IUPAC name of 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide?
The IUPAC name of 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide (CID 95906025) is 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide?
The canonical SMILES for 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide is C[C@@H](NC(=O)Cn1ncc2ccccc21)c1cccc(-n2cccn2)c1.
What is the InChIKey of 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide?
The InChIKey is RYPXMNAFGKESIZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H19N5O/c1-15(16-7-4-8-18(12-16)24-11-5-10-21-24)23-20(26)14-25-19-9-3-2-6-17(19)13-22-25/h2-13,15H,14H2,1H3,(H,23,26)/t15-/m1/s1.
What are the key properties of 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide?
2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide has a molecular weight of 345.41 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indazol-1-yl-N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]acetamide is sourced from PubChem (CID 95906025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).