2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide

C12H20N4O — CID 64677819

IUPAC2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide
SMILESNC1(CC(=O)NCCn2cccn2)CCCC1
InChIInChI=1S/C12H20N4O/c13-12(4-1-2-5-12)10-11(17)14-7-9-16-8-3-6-15-16/h3,6,8H,1-2,4-5,7,9-10,13H2,(H,14,17)
InChIKeyNAQXXINNGXIKDK-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.66
Rot. Bonds5

About 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide

2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide (PubChem CID 64677819) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide
PubChem CID64677819
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide
SMILESNC1(CC(=O)NCCn2cccn2)CCCC1
InChIInChI=1S/C12H20N4O/c13-12(4-1-2-5-12)10-11(17)14-7-9-16-8-3-6-15-16/h3,6,8H,1-2,4-5,7,9-10,13H2,(H,14,17)
InChIKeyNAQXXINNGXIKDK-UHFFFAOYSA-N
XLogP0.66
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide (CID 64677819) is 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide is NC1(CC(=O)NCCn2cccn2)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide?
The InChIKey is NAQXXINNGXIKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c13-12(4-1-2-5-12)10-11(17)14-7-9-16-8-3-6-15-16/h3,6,8H,1-2,4-5,7,9-10,13H2,(H,14,17).
What are the key properties of 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide?
2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide has a molecular weight of 236.32 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-(2-pyrazol-1-ylethyl)acetamide is sourced from PubChem (CID 64677819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).