2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium

C19H26N5+ — CID 7619003

IUPAC2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium
SMILESCCc1nn2c(NCC[NH+](C)C)cc(C)nc2c1-c1ccccc1
InChIInChI=1S/C19H25N5/c1-5-16-18(15-9-7-6-8-10-15)19-21-14(2)13-17(24(19)22-16)20-11-12-23(3)4/h6-10,13,20H,5,11-12H2,1-4H3/p+1
InChIKeyVMWVKYAPCWUPSH-UHFFFAOYSA-O
MW324.45 g/mol
LogP1.82
Rot. Bonds6

About 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium

2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium (PubChem CID 7619003) has the molecular formula C19H26N5+ and a molecular weight of 324.45 g/mol. Its IUPAC name is 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium.

Molecular Properties

Compound Name2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium
PubChem CID7619003
Molecular FormulaC19H26N5+
Molecular Weight324.45 g/mol
Exact Mass324.22
IUPAC Name2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium
SMILESCCc1nn2c(NCC[NH+](C)C)cc(C)nc2c1-c1ccccc1
InChIInChI=1S/C19H25N5/c1-5-16-18(15-9-7-6-8-10-15)19-21-14(2)13-17(24(19)22-16)20-11-12-23(3)4/h6-10,13,20H,5,11-12H2,1-4H3/p+1
InChIKeyVMWVKYAPCWUPSH-UHFFFAOYSA-O
XLogP1.82
TPSA46.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium 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 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium?
The IUPAC name of 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium (CID 7619003) is 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium.
What is the SMILES notation for 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium?
The canonical SMILES for 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium is CCc1nn2c(NCC[NH+](C)C)cc(C)nc2c1-c1ccccc1.
What is the InChIKey of 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium?
The InChIKey is VMWVKYAPCWUPSH-UHFFFAOYSA-O. The full InChI is InChI=1S/C19H25N5/c1-5-16-18(15-9-7-6-8-10-15)19-21-14(2)13-17(24(19)22-16)20-11-12-23(3)4/h6-10,13,20H,5,11-12H2,1-4H3/p+1.
What are the key properties of 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium?
2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium has a molecular weight of 324.45 g/mol, XLogP of 1.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl-dimethylazanium is sourced from PubChem (CID 7619003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).