N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine

C21H23N5 — CID 24890346

IUPACN-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine
SMILESCc1cccc(C)c1CNc1cc(-n2cccn2)cn2c(C)c(C)nc12
InChIInChI=1S/C21H23N5/c1-14-7-5-8-15(2)19(14)12-22-20-11-18(26-10-6-9-23-26)13-25-17(4)16(3)24-21(20)25/h5-11,13,22H,12H2,1-4H3
InChIKeyNVTYARUVRYHLSU-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.37
Rot. Bonds4

About N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine

N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine (PubChem CID 24890346) has the molecular formula C21H23N5 and a molecular weight of 345.45 g/mol. Its IUPAC name is N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine.

Molecular Properties

Compound NameN-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine
PubChem CID24890346
Molecular FormulaC21H23N5
Molecular Weight345.45 g/mol
Exact Mass345.20
IUPAC NameN-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine
SMILESCc1cccc(C)c1CNc1cc(-n2cccn2)cn2c(C)c(C)nc12
InChIInChI=1S/C21H23N5/c1-14-7-5-8-15(2)19(14)12-22-20-11-18(26-10-6-9-23-26)13-25-17(4)16(3)24-21(20)25/h5-11,13,22H,12H2,1-4H3
InChIKeyNVTYARUVRYHLSU-UHFFFAOYSA-N
XLogP4.37
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine?
The IUPAC name of N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine (CID 24890346) is N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine.
What is the SMILES notation for N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine?
The canonical SMILES for N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine is Cc1cccc(C)c1CNc1cc(-n2cccn2)cn2c(C)c(C)nc12.
What is the InChIKey of N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine?
The InChIKey is NVTYARUVRYHLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5/c1-14-7-5-8-15(2)19(14)12-22-20-11-18(26-10-6-9-23-26)13-25-17(4)16(3)24-21(20)25/h5-11,13,22H,12H2,1-4H3.
What are the key properties of N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine?
N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine has a molecular weight of 345.45 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-pyrazol-1-ylimidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 24890346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).