N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine

C19H26N6 — CID 56917261

IUPACN,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine
SMILESCc1cc2nc(C(C)C)cc(NCC(c3ccccn3)N(C)C)n2n1
InChIInChI=1S/C19H26N6/c1-13(2)16-11-18(25-19(22-16)10-14(3)23-25)21-12-17(24(4)5)15-8-6-7-9-20-15/h6-11,13,17,21H,12H2,1-5H3
InChIKeyLAPAXZOLAXRSMM-UHFFFAOYSA-N
MW338.46 g/mol
LogP3.27
Rot. Bonds6

About N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine

N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine (PubChem CID 56917261) has the molecular formula C19H26N6 and a molecular weight of 338.46 g/mol. Its IUPAC name is N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine
PubChem CID56917261
Molecular FormulaC19H26N6
Molecular Weight338.46 g/mol
Exact Mass338.22
IUPAC NameN,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine
SMILESCc1cc2nc(C(C)C)cc(NCC(c3ccccn3)N(C)C)n2n1
InChIInChI=1S/C19H26N6/c1-13(2)16-11-18(25-19(22-16)10-14(3)23-25)21-12-17(24(4)5)15-8-6-7-9-20-15/h6-11,13,17,21H,12H2,1-5H3
InChIKeyLAPAXZOLAXRSMM-UHFFFAOYSA-N
XLogP3.27
TPSA58.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-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,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine?
The IUPAC name of N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine (CID 56917261) is N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine.
What is the SMILES notation for N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine?
The canonical SMILES for N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine is Cc1cc2nc(C(C)C)cc(NCC(c3ccccn3)N(C)C)n2n1.
What is the InChIKey of N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine?
The InChIKey is LAPAXZOLAXRSMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6/c1-13(2)16-11-18(25-19(22-16)10-14(3)23-25)21-12-17(24(4)5)15-8-6-7-9-20-15/h6-11,13,17,21H,12H2,1-5H3.
What are the key properties of N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine?
N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine has a molecular weight of 338.46 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-N'-(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-1-pyridin-2-ylethane-1,2-diamine is sourced from PubChem (CID 56917261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).