(5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone

C10H16N4O — CID 110837893

IUPAC(5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone
SMILESCc1cc(N)n(C(=O)C2CCCCN2)n1
InChIInChI=1S/C10H16N4O/c1-7-6-9(11)14(13-7)10(15)8-4-2-3-5-12-8/h6,8,12H,2-5,11H2,1H3
InChIKeyNIWIRNBNEDGULT-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.56
Rot. Bonds1

About (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone

(5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone (PubChem CID 110837893) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone.

Molecular Properties

Compound Name(5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone
PubChem CID110837893
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name(5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone
SMILESCc1cc(N)n(C(=O)C2CCCCN2)n1
InChIInChI=1S/C10H16N4O/c1-7-6-9(11)14(13-7)10(15)8-4-2-3-5-12-8/h6,8,12H,2-5,11H2,1H3
InChIKeyNIWIRNBNEDGULT-UHFFFAOYSA-N
XLogP0.56
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone?
The IUPAC name of (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone (CID 110837893) is (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone.
What is the SMILES notation for (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone?
The canonical SMILES for (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone is Cc1cc(N)n(C(=O)C2CCCCN2)n1.
What is the InChIKey of (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone?
The InChIKey is NIWIRNBNEDGULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-6-9(11)14(13-7)10(15)8-4-2-3-5-12-8/h6,8,12H,2-5,11H2,1H3.
What are the key properties of (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone?
(5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone has a molecular weight of 208.26 g/mol, XLogP of 0.56, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-3-methylpyrazol-1-yl)-piperidin-2-ylmethanone is sourced from PubChem (CID 110837893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).