N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine

C22H21N3 — CID 808812

IUPACN-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccccc1-c1nc2c(C)cccn2c1NCc1ccccc1
InChIInChI=1S/C22H21N3/c1-16-9-6-7-13-19(16)20-22(23-15-18-11-4-3-5-12-18)25-14-8-10-17(2)21(25)24-20/h3-14,23H,15H2,1-2H3
InChIKeyHVMFFSHFNBBOBE-UHFFFAOYSA-N
MW327.43 g/mol
LogP5.23
Rot. Bonds4

About N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine

N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 808812) has the molecular formula C22H21N3 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID808812
Molecular FormulaC22H21N3
Molecular Weight327.43 g/mol
Exact Mass327.17
IUPAC NameN-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccccc1-c1nc2c(C)cccn2c1NCc1ccccc1
InChIInChI=1S/C22H21N3/c1-16-9-6-7-13-19(16)20-22(23-15-18-11-4-3-5-12-18)25-14-8-10-17(2)21(25)24-20/h3-14,23H,15H2,1-2H3
InChIKeyHVMFFSHFNBBOBE-UHFFFAOYSA-N
XLogP5.23
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.43
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-(2-methylphenyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 3532130
[2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 2,2-dimethylpropanoate
CID 42743732
[2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 2-methoxybenzoate
CID 3997507
[2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 2-phenylmethoxyacetate
CID 3997505
[2-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 3,5-dimethoxybenzoate
CID 3994721
N-benzyl-5,7-dimethyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 808782
[3-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 4-phenylbenzoate
CID 42743727
[3-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 2-chloropropanoate
CID 3899423
4-O-[3-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 1-O-ethyl butanedioate
CID 4990255
[3-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] (E)-3-phenylprop-2-enoate
CID 6050171
[3-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] heptanoate
CID 4253763
2-[3-(benzylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenol
CID 809543

Frequently Asked Questions

What is the IUPAC name of N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine (CID 808812) is N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine is Cc1ccccc1-c1nc2c(C)cccn2c1NCc1ccccc1.
What is the InChIKey of N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is HVMFFSHFNBBOBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3/c1-16-9-6-7-13-19(16)20-22(23-15-18-11-4-3-5-12-18)25-14-8-10-17(2)21(25)24-20/h3-14,23H,15H2,1-2H3.
What are the key properties of N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 327.43 g/mol, XLogP of 5.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-8-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 808812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).