N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide

C16H24N6O — CID 71973384

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide
SMILESCCc1nc(CC)n(CC(=O)Nc2ccnn2C2CCCC2)n1
InChIInChI=1S/C16H24N6O/c1-3-13-18-14(4-2)21(20-13)11-16(23)19-15-9-10-17-22(15)12-7-5-6-8-12/h9-10,12H,3-8,11H2,1-2H3,(H,19,23)
InChIKeyNZXHSUVNCXVPNZ-UHFFFAOYSA-N
MW316.41 g/mol
LogP2.35
Rot. Bonds6

About N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide (PubChem CID 71973384) has the molecular formula C16H24N6O and a molecular weight of 316.41 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide
PubChem CID71973384
Molecular FormulaC16H24N6O
Molecular Weight316.41 g/mol
Exact Mass316.20
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide
SMILESCCc1nc(CC)n(CC(=O)Nc2ccnn2C2CCCC2)n1
InChIInChI=1S/C16H24N6O/c1-3-13-18-14(4-2)21(20-13)11-16(23)19-15-9-10-17-22(15)12-7-5-6-8-12/h9-10,12H,3-8,11H2,1-2H3,(H,19,23)
InChIKeyNZXHSUVNCXVPNZ-UHFFFAOYSA-N
XLogP2.35
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide (CID 71973384) is N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide is CCc1nc(CC)n(CC(=O)Nc2ccnn2C2CCCC2)n1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide?
The InChIKey is NZXHSUVNCXVPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O/c1-3-13-18-14(4-2)21(20-13)11-16(23)19-15-9-10-17-22(15)12-7-5-6-8-12/h9-10,12H,3-8,11H2,1-2H3,(H,19,23).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide has a molecular weight of 316.41 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-2-(3,5-diethyl-1,2,4-triazol-1-yl)acetamide is sourced from PubChem (CID 71973384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).