N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine

C23H23N3O2 — CID 3205789

IUPACN-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(-c2nc3ccc(C)cn3c2NCc2ccccc2)cc1OC
InChIInChI=1S/C23H23N3O2/c1-16-9-12-21-25-22(18-10-11-19(27-2)20(13-18)28-3)23(26(21)15-16)24-14-17-7-5-4-6-8-17/h4-13,15,24H,14H2,1-3H3
InChIKeyBARIGRGUFRRRMV-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.94
Rot. Bonds6

About N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine

N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 3205789) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID3205789
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(-c2nc3ccc(C)cn3c2NCc2ccccc2)cc1OC
InChIInChI=1S/C23H23N3O2/c1-16-9-12-21-25-22(18-10-11-19(27-2)20(13-18)28-3)23(26(21)15-16)24-14-17-7-5-4-6-8-17/h4-13,15,24H,14H2,1-3H3
InChIKeyBARIGRGUFRRRMV-UHFFFAOYSA-N
XLogP4.94
TPSA47.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine (CID 3205789) is N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine is COc1ccc(-c2nc3ccc(C)cn3c2NCc2ccccc2)cc1OC.
What is the InChIKey of N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is BARIGRGUFRRRMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-16-9-12-21-25-22(18-10-11-19(27-2)20(13-18)28-3)23(26(21)15-16)24-14-17-7-5-4-6-8-17/h4-13,15,24H,14H2,1-3H3.
What are the key properties of N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine?
N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 373.46 g/mol, XLogP of 4.94, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 3205789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).