2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide

C18H20N4O — CID 70296765

IUPAC2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide
SMILESCc1cccc(C(N)=O)c1CNc1cccn2c(C)c(C)nc12
InChIInChI=1S/C18H20N4O/c1-11-6-4-7-14(17(19)23)15(11)10-20-16-8-5-9-22-13(3)12(2)21-18(16)22/h4-9,20H,10H2,1-3H3,(H2,19,23)
InChIKeyWIRKQHPWPMRPNS-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.97
Rot. Bonds4

About 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide

2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide (PubChem CID 70296765) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide.

Molecular Properties

Compound Name2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide
PubChem CID70296765
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC Name2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide
SMILESCc1cccc(C(N)=O)c1CNc1cccn2c(C)c(C)nc12
InChIInChI=1S/C18H20N4O/c1-11-6-4-7-14(17(19)23)15(11)10-20-16-8-5-9-22-13(3)12(2)21-18(16)22/h4-9,20H,10H2,1-3H3,(H2,19,23)
InChIKeyWIRKQHPWPMRPNS-UHFFFAOYSA-N
XLogP2.97
TPSA72.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide?
The IUPAC name of 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide (CID 70296765) is 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide.
What is the SMILES notation for 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide?
The canonical SMILES for 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide is Cc1cccc(C(N)=O)c1CNc1cccn2c(C)c(C)nc12.
What is the InChIKey of 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide?
The InChIKey is WIRKQHPWPMRPNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-11-6-4-7-14(17(19)23)15(11)10-20-16-8-5-9-22-13(3)12(2)21-18(16)22/h4-9,20H,10H2,1-3H3,(H2,19,23).
What are the key properties of 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide?
2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide has a molecular weight of 308.39 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylbenzamide is sourced from PubChem (CID 70296765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).