(7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone

C14H18N4O — CID 53015025

IUPAC(7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone
SMILESCC(C)c1cc(C(=O)N2CCCC2)nc2ccnn12
InChIInChI=1S/C14H18N4O/c1-10(2)12-9-11(14(19)17-7-3-4-8-17)16-13-5-6-15-18(12)13/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyHTGDDPTUNHFABO-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.09
Rot. Bonds2

About (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone

(7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone (PubChem CID 53015025) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone
PubChem CID53015025
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name(7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone
SMILESCC(C)c1cc(C(=O)N2CCCC2)nc2ccnn12
InChIInChI=1S/C14H18N4O/c1-10(2)12-9-11(14(19)17-7-3-4-8-17)16-13-5-6-15-18(12)13/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyHTGDDPTUNHFABO-UHFFFAOYSA-N
XLogP2.09
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-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 (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone (CID 53015025) is (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone is CC(C)c1cc(C(=O)N2CCCC2)nc2ccnn12.
What is the InChIKey of (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is HTGDDPTUNHFABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10(2)12-9-11(14(19)17-7-3-4-8-17)16-13-5-6-15-18(12)13/h5-6,9-10H,3-4,7-8H2,1-2H3.
What are the key properties of (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone?
(7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 258.32 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 53015025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).