2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide

C16H19N3O2 — CID 111432531

IUPAC2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide
SMILESO=C(CC1(O)CCCC1)Nc1cnn(-c2ccccc2)c1
InChIInChI=1S/C16H19N3O2/c20-15(10-16(21)8-4-5-9-16)18-13-11-17-19(12-13)14-6-2-1-3-7-14/h1-3,6-7,11-12,21H,4-5,8-10H2,(H,18,20)
InChIKeyNZFKQLFMLWZJRH-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.51
Rot. Bonds4

About 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide

2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide (PubChem CID 111432531) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide
PubChem CID111432531
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide
SMILESO=C(CC1(O)CCCC1)Nc1cnn(-c2ccccc2)c1
InChIInChI=1S/C16H19N3O2/c20-15(10-16(21)8-4-5-9-16)18-13-11-17-19(12-13)14-6-2-1-3-7-14/h1-3,6-7,11-12,21H,4-5,8-10H2,(H,18,20)
InChIKeyNZFKQLFMLWZJRH-UHFFFAOYSA-N
XLogP2.51
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide?
The IUPAC name of 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide (CID 111432531) is 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide is O=C(CC1(O)CCCC1)Nc1cnn(-c2ccccc2)c1.
What is the InChIKey of 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide?
The InChIKey is NZFKQLFMLWZJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c20-15(10-16(21)8-4-5-9-16)18-13-11-17-19(12-13)14-6-2-1-3-7-14/h1-3,6-7,11-12,21H,4-5,8-10H2,(H,18,20).
What are the key properties of 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide?
2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide is sourced from PubChem (CID 111432531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).