2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide

C14H16N4O — CID 62113920

IUPAC2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide
SMILESNc1ccn(CC(=O)NC2CC2c2ccccc2)n1
InChIInChI=1S/C14H16N4O/c15-13-6-7-18(17-13)9-14(19)16-12-8-11(12)10-4-2-1-3-5-10/h1-7,11-12H,8-9H2,(H2,15,17)(H,16,19)
InChIKeyZUSOGYKIUCZJFX-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.14
Rot. Bonds4

About 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide

2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide (PubChem CID 62113920) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide
PubChem CID62113920
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide
SMILESNc1ccn(CC(=O)NC2CC2c2ccccc2)n1
InChIInChI=1S/C14H16N4O/c15-13-6-7-18(17-13)9-14(19)16-12-8-11(12)10-4-2-1-3-5-10/h1-7,11-12H,8-9H2,(H2,15,17)(H,16,19)
InChIKeyZUSOGYKIUCZJFX-UHFFFAOYSA-N
XLogP1.14
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide (CID 62113920) is 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide is Nc1ccn(CC(=O)NC2CC2c2ccccc2)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide?
The InChIKey is ZUSOGYKIUCZJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c15-13-6-7-18(17-13)9-14(19)16-12-8-11(12)10-4-2-1-3-5-10/h1-7,11-12H,8-9H2,(H2,15,17)(H,16,19).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide?
2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide has a molecular weight of 256.31 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-(2-phenylcyclopropyl)acetamide is sourced from PubChem (CID 62113920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).