N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide

C19H21N5O2 — CID 78772056

IUPACN-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESO=C(Cn1c(=O)cnc2ccccc21)Nc1ccnn1C1CCCCC1
InChIInChI=1S/C19H21N5O2/c25-18(13-23-16-9-5-4-8-15(16)20-12-19(23)26)22-17-10-11-21-24(17)14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7,13H2,(H,22,25)
InChIKeyFRFJPRFCICKPAK-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.74
Rot. Bonds4

About N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide

N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide (PubChem CID 78772056) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide
PubChem CID78772056
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC NameN-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESO=C(Cn1c(=O)cnc2ccccc21)Nc1ccnn1C1CCCCC1
InChIInChI=1S/C19H21N5O2/c25-18(13-23-16-9-5-4-8-15(16)20-12-19(23)26)22-17-10-11-21-24(17)14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7,13H2,(H,22,25)
InChIKeyFRFJPRFCICKPAK-UHFFFAOYSA-N
XLogP2.74
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide?
The IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide (CID 78772056) is N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide?
The canonical SMILES for N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide is O=C(Cn1c(=O)cnc2ccccc21)Nc1ccnn1C1CCCCC1.
What is the InChIKey of N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide?
The InChIKey is FRFJPRFCICKPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c25-18(13-23-16-9-5-4-8-15(16)20-12-19(23)26)22-17-10-11-21-24(17)14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7,13H2,(H,22,25).
What are the key properties of N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide?
N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide has a molecular weight of 351.41 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylpyrazol-3-yl)-2-(2-oxoquinoxalin-1-yl)acetamide is sourced from PubChem (CID 78772056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).