N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide

C15H16N4O — CID 53195935

IUPACN-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide
SMILESCCn1c(-c2cc(NC(C)=O)n[nH]2)cc2ccccc21
InChIInChI=1S/C15H16N4O/c1-3-19-13-7-5-4-6-11(13)8-14(19)12-9-15(18-17-12)16-10(2)20/h4-9H,3H2,1-2H3,(H2,16,17,18,20)
InChIKeySAFYBSSJMNYXRI-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.01
Rot. Bonds3

About N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide

N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide (PubChem CID 53195935) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide.

Molecular Properties

Compound NameN-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide
PubChem CID53195935
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide
SMILESCCn1c(-c2cc(NC(C)=O)n[nH]2)cc2ccccc21
InChIInChI=1S/C15H16N4O/c1-3-19-13-7-5-4-6-11(13)8-14(19)12-9-15(18-17-12)16-10(2)20/h4-9H,3H2,1-2H3,(H2,16,17,18,20)
InChIKeySAFYBSSJMNYXRI-UHFFFAOYSA-N
XLogP3.01
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide?
The IUPAC name of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide (CID 53195935) is N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide.
What is the SMILES notation for N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide?
The canonical SMILES for N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide is CCn1c(-c2cc(NC(C)=O)n[nH]2)cc2ccccc21.
What is the InChIKey of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide?
The InChIKey is SAFYBSSJMNYXRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-3-19-13-7-5-4-6-11(13)8-14(19)12-9-15(18-17-12)16-10(2)20/h4-9H,3H2,1-2H3,(H2,16,17,18,20).
What are the key properties of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide?
N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide has a molecular weight of 268.32 g/mol, XLogP of 3.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]acetamide is sourced from PubChem (CID 53195935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).