N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide

C21H26N4O — CID 8754067

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide
SMILESO=C(CN1CC=C(c2ccccc2)CC1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C21H26N4O/c26-21(23-20-10-13-22-25(20)19-8-4-5-9-19)16-24-14-11-18(12-15-24)17-6-2-1-3-7-17/h1-3,6-7,10-11,13,19H,4-5,8-9,12,14-16H2,(H,23,26)
InChIKeyTZRIPZWKIADHOZ-UHFFFAOYSA-N
MW350.47 g/mol
LogP3.73
Rot. Bonds5

About N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide (PubChem CID 8754067) has the molecular formula C21H26N4O and a molecular weight of 350.47 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide
PubChem CID8754067
Molecular FormulaC21H26N4O
Molecular Weight350.47 g/mol
Exact Mass350.21
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide
SMILESO=C(CN1CC=C(c2ccccc2)CC1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C21H26N4O/c26-21(23-20-10-13-22-25(20)19-8-4-5-9-19)16-24-14-11-18(12-15-24)17-6-2-1-3-7-17/h1-3,6-7,10-11,13,19H,4-5,8-9,12,14-16H2,(H,23,26)
InChIKeyTZRIPZWKIADHOZ-UHFFFAOYSA-N
XLogP3.73
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide (CID 8754067) is N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide is O=C(CN1CC=C(c2ccccc2)CC1)Nc1ccnn1C1CCCC1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
The InChIKey is TZRIPZWKIADHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O/c26-21(23-20-10-13-22-25(20)19-8-4-5-9-19)16-24-14-11-18(12-15-24)17-6-2-1-3-7-17/h1-3,6-7,10-11,13,19H,4-5,8-9,12,14-16H2,(H,23,26).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide has a molecular weight of 350.47 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide is sourced from PubChem (CID 8754067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).