N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine

C19H21N5 — CID 143597985

IUPACN-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNc1ccn2ncc(C3=Cc4ccccc4C3)c2n1
InChIInChI=1S/C19H21N5/c1-23(2)10-8-20-18-7-9-24-19(22-18)17(13-21-24)16-11-14-5-3-4-6-15(14)12-16/h3-7,9,11,13H,8,10,12H2,1-2H3,(H,20,22)
InChIKeyMAMPVRMCOXCYGO-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.80
Rot. Bonds5

About N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine

N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine (PubChem CID 143597985) has the molecular formula C19H21N5 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine
PubChem CID143597985
Molecular FormulaC19H21N5
Molecular Weight319.41 g/mol
Exact Mass319.18
IUPAC NameN-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNc1ccn2ncc(C3=Cc4ccccc4C3)c2n1
InChIInChI=1S/C19H21N5/c1-23(2)10-8-20-18-7-9-24-19(22-18)17(13-21-24)16-11-14-5-3-4-6-15(14)12-16/h3-7,9,11,13H,8,10,12H2,1-2H3,(H,20,22)
InChIKeyMAMPVRMCOXCYGO-UHFFFAOYSA-N
XLogP2.80
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine 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 N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine (CID 143597985) is N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine is CN(C)CCNc1ccn2ncc(C3=Cc4ccccc4C3)c2n1.
What is the InChIKey of N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine?
The InChIKey is MAMPVRMCOXCYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5/c1-23(2)10-8-20-18-7-9-24-19(22-18)17(13-21-24)16-11-14-5-3-4-6-15(14)12-16/h3-7,9,11,13H,8,10,12H2,1-2H3,(H,20,22).
What are the key properties of N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine?
N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine has a molecular weight of 319.41 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1H-inden-2-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 143597985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).