2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide

C14H14N4O — CID 112524746

IUPAC2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)Cc2ccc3cc[nH]c3c2)n[nH]1
InChIInChI=1S/C14H14N4O/c1-9-6-13(18-17-9)16-14(19)8-10-2-3-11-4-5-15-12(11)7-10/h2-7,15H,8H2,1H3,(H2,16,17,18,19)
InChIKeyAZPJZGLJGWGUBP-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.38
Rot. Bonds3

About 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide

2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide (PubChem CID 112524746) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
PubChem CID112524746
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)Cc2ccc3cc[nH]c3c2)n[nH]1
InChIInChI=1S/C14H14N4O/c1-9-6-13(18-17-9)16-14(19)8-10-2-3-11-4-5-15-12(11)7-10/h2-7,15H,8H2,1H3,(H2,16,17,18,19)
InChIKeyAZPJZGLJGWGUBP-UHFFFAOYSA-N
XLogP2.38
TPSA73.57 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
The IUPAC name of 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide (CID 112524746) is 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
The canonical SMILES for 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide is Cc1cc(NC(=O)Cc2ccc3cc[nH]c3c2)n[nH]1.
What is the InChIKey of 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
The InChIKey is AZPJZGLJGWGUBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-9-6-13(18-17-9)16-14(19)8-10-2-3-11-4-5-15-12(11)7-10/h2-7,15H,8H2,1H3,(H2,16,17,18,19).
What are the key properties of 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide has a molecular weight of 254.29 g/mol, XLogP of 2.38, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide is sourced from PubChem (CID 112524746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).