1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine

C18H23N5 — CID 142198957

IUPAC1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccn2c(-c3ccncn3)c(C(C)(C)C)nc2c1
InChIInChI=1S/C18H23N5/c1-18(2,3)17-16(14-6-8-19-12-20-14)23-9-7-13(11-22(4)5)10-15(23)21-17/h6-10,12H,11H2,1-5H3
InChIKeyKPUAWEFLOOWFMG-UHFFFAOYSA-N
MW309.42 g/mol
LogP3.15
Rot. Bonds3

About 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine

1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine (PubChem CID 142198957) has the molecular formula C18H23N5 and a molecular weight of 309.42 g/mol. Its IUPAC name is 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine
PubChem CID142198957
Molecular FormulaC18H23N5
Molecular Weight309.42 g/mol
Exact Mass309.20
IUPAC Name1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccn2c(-c3ccncn3)c(C(C)(C)C)nc2c1
InChIInChI=1S/C18H23N5/c1-18(2,3)17-16(14-6-8-19-12-20-14)23-9-7-13(11-22(4)5)10-15(23)21-17/h6-10,12H,11H2,1-5H3
InChIKeyKPUAWEFLOOWFMG-UHFFFAOYSA-N
XLogP3.15
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.42
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine (CID 142198957) is 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine is CN(C)Cc1ccn2c(-c3ccncn3)c(C(C)(C)C)nc2c1.
What is the InChIKey of 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine?
The InChIKey is KPUAWEFLOOWFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5/c1-18(2,3)17-16(14-6-8-19-12-20-14)23-9-7-13(11-22(4)5)10-15(23)21-17/h6-10,12H,11H2,1-5H3.
What are the key properties of 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine?
1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine has a molecular weight of 309.42 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butyl-3-pyrimidin-4-ylimidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 142198957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).