[2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine

C12H10BrN3S — CID 107355567

IUPAC[2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2nc(-c3cc(Br)cs3)cn2c1
InChIInChI=1S/C12H10BrN3S/c13-9-3-11(17-7-9)10-6-16-5-8(4-14)1-2-12(16)15-10/h1-3,5-7H,4,14H2
InChIKeyKGCAMHAUVSDAGV-UHFFFAOYSA-N
MW308.20 g/mol
LogP3.28
Rot. Bonds2

About [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine

[2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 107355567) has the molecular formula C12H10BrN3S and a molecular weight of 308.20 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID107355567
Molecular FormulaC12H10BrN3S
Molecular Weight308.20 g/mol
Exact Mass306.98
IUPAC Name[2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2nc(-c3cc(Br)cs3)cn2c1
InChIInChI=1S/C12H10BrN3S/c13-9-3-11(17-7-9)10-6-16-5-8(4-14)1-2-12(16)15-10/h1-3,5-7H,4,14H2
InChIKeyKGCAMHAUVSDAGV-UHFFFAOYSA-N
XLogP3.28
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.20
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(5-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81462365
[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 82973931
[2-(4-ethylphenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 79021351
[2-(furan-3-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81463266
(2-pyridin-2-ylimidazo[1,2-a]pyridin-6-yl)methanamine
CID 82059890
3-[6-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]phenol
CID 117130711
[2-(2,4-dichloro-5-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81462454
2-[4-(4-bromothiophen-2-yl)-2-methylimidazol-1-yl]ethanamine
CID 82307623
[2-(2,5-difluoro-4-methylphenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81462814
[2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81462901
[2-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81463077
2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyrimidine
CID 107355573

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine (CID 107355567) is [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine is NCc1ccc2nc(-c3cc(Br)cs3)cn2c1.
What is the InChIKey of [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is KGCAMHAUVSDAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3S/c13-9-3-11(17-7-9)10-6-16-5-8(4-14)1-2-12(16)15-10/h1-3,5-7H,4,14H2.
What are the key properties of [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine?
[2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 308.20 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 107355567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).