2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine

C47H47BrN10O — CID 159347323

IUPAC2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine
SMILESCNc1ccn2cc(-c3ccc(Br)cc3)nc2c1.CNc1ccn2cc(-c3ccc(N4CCCCC4)cc3)nc2c1.CNc1ccn2cc(-c3ccccc3O)nc2c1
InChIInChI=1S/C19H22N4.C14H12BrN3.C14H13N3O/c1-20-16-9-12-23-14-18(21-19(23)13-16)15-5-7-17(8-6-15)22-10-3-2-4-11-22;1-16-12-6-7-18-9-13(17-14(18)8-12)10-2-4-11(15)5-3-10;1-15-10-6-7-17-9-12(16-14(17)8-10)11-4-2-3-5-13(11)18/h5-9,12-14,20H,2-4,10-11H2,1H3;2-9,16H,1H3;2-9,15,18H,1H3
InChIKeyLGWUOTFBMGNLOV-UHFFFAOYSA-N
MW847.87 g/mol
LogP10.59
Rot. Bonds7

About 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine

2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine (PubChem CID 159347323) has the molecular formula C47H47BrN10O and a molecular weight of 847.87 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine
PubChem CID159347323
Molecular FormulaC47H47BrN10O
Molecular Weight847.87 g/mol
Exact Mass846.31
IUPAC Name2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine
SMILESCNc1ccn2cc(-c3ccc(Br)cc3)nc2c1.CNc1ccn2cc(-c3ccc(N4CCCCC4)cc3)nc2c1.CNc1ccn2cc(-c3ccccc3O)nc2c1
InChIInChI=1S/C19H22N4.C14H12BrN3.C14H13N3O/c1-20-16-9-12-23-14-18(21-19(23)13-16)15-5-7-17(8-6-15)22-10-3-2-4-11-22;1-16-12-6-7-18-9-13(17-14(18)8-12)10-2-4-11(15)5-3-10;1-15-10-6-7-17-9-12(16-14(17)8-10)11-4-2-3-5-13(11)18/h5-9,12-14,20H,2-4,10-11H2,1H3;2-9,16H,1H3;2-9,15,18H,1H3
InChIKeyLGWUOTFBMGNLOV-UHFFFAOYSA-N
XLogP10.59
TPSA111.46 Ų
H-Bond Donors4
H-Bond Acceptors11
Rotatable Bonds7
Heavy Atoms59
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500847.87
LogP ≤ 510.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1011

Analyze 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine with MolForge

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Related Compounds

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CID 71596217
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(9R)-5-bromo-9'-hydroxyspiro[8-oxa-16-aza-10-azonia-9-boranuidatetracyclo[8.7.0.02,7.011,16]heptadeca-1(17),2(7),3,5,10,12,14-heptaene-9,7'-8-oxa-9-bora-7-boranuidabicyclo[4.3.0]nona-1,3,5-triene]
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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine?
The IUPAC name of 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine (CID 159347323) is 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine.
What is the SMILES notation for 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine?
The canonical SMILES for 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine is CNc1ccn2cc(-c3ccc(Br)cc3)nc2c1.CNc1ccn2cc(-c3ccc(N4CCCCC4)cc3)nc2c1.CNc1ccn2cc(-c3ccccc3O)nc2c1.
What is the InChIKey of 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine?
The InChIKey is LGWUOTFBMGNLOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4.C14H12BrN3.C14H13N3O/c1-20-16-9-12-23-14-18(21-19(23)13-16)15-5-7-17(8-6-15)22-10-3-2-4-11-22;1-16-12-6-7-18-9-13(17-14(18)8-12)10-2-4-11(15)5-3-10;1-15-10-6-7-17-9-12(16-14(17)8-10)11-4-2-3-5-13(11)18/h5-9,12-14,20H,2-4,10-11H2,1H3;2-9,16H,1H3;2-9,15,18H,1H3.
What are the key properties of 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine?
2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine has a molecular weight of 847.87 g/mol, XLogP of 10.59, 7 rotatable bonds, 4 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-methylimidazo[1,2-a]pyridin-7-amine;2-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-methyl-2-(4-piperidin-1-ylphenyl)imidazo[1,2-a]pyridin-7-amine is sourced from PubChem (CID 159347323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).