1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine

C12H14BrN3O — CID 117249504

IUPAC1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
SMILESNC1CCn2c(Cc3ccco3)nc(Br)c2C1
InChIInChI=1S/C12H14BrN3O/c13-12-10-6-8(14)3-4-16(10)11(15-12)7-9-2-1-5-17-9/h1-2,5,8H,3-4,6-7,14H2
InChIKeyLZHFUWTZCTWRLW-UHFFFAOYSA-N
MW296.17 g/mol
LogP2.10
Rot. Bonds2

About 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine

1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine (PubChem CID 117249504) has the molecular formula C12H14BrN3O and a molecular weight of 296.17 g/mol. Its IUPAC name is 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine.

Molecular Properties

Compound Name1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
PubChem CID117249504
Molecular FormulaC12H14BrN3O
Molecular Weight296.17 g/mol
Exact Mass295.03
IUPAC Name1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
SMILESNC1CCn2c(Cc3ccco3)nc(Br)c2C1
InChIInChI=1S/C12H14BrN3O/c13-12-10-6-8(14)3-4-16(10)11(15-12)7-9-2-1-5-17-9/h1-2,5,8H,3-4,6-7,14H2
InChIKeyLZHFUWTZCTWRLW-UHFFFAOYSA-N
XLogP2.10
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.17
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine with MolForge

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Related Compounds

1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
CID 117249506
3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine
CID 117151844
1-bromo-3-(furan-2-ylmethyl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117250210
1-bromo-3-(furan-2-ylmethyl)imidazo[1,5-a]pyridin-5-amine
CID 117250918
1-(furan-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
CID 53422470
1-(3-aminopyrrolidin-1-yl)-2-(furan-2-yl)ethanone
CID 83619262
1-(furan-2-ylmethyl)piperidine;methanamine
CID 162741090
1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine
CID 169242230
6-bromo-2-(furan-2-ylmethyl)imidazo[1,2-a]pyridine
CID 117130982
2-(cyclobutylmethyl)furan
CID 139469251
1-(furan-2-ylmethyl)-N-methylpiperidin-4-amine;hydrochloride
CID 86253291
2-[4-(furan-2-ylmethyl)piperazin-1-yl]aniline
CID 19626878

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine?
The IUPAC name of 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine (CID 117249504) is 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine.
What is the SMILES notation for 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine?
The canonical SMILES for 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine is NC1CCn2c(Cc3ccco3)nc(Br)c2C1.
What is the InChIKey of 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine?
The InChIKey is LZHFUWTZCTWRLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3O/c13-12-10-6-8(14)3-4-16(10)11(15-12)7-9-2-1-5-17-9/h1-2,5,8H,3-4,6-7,14H2.
What are the key properties of 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine?
1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine has a molecular weight of 296.17 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(furan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-amine is sourced from PubChem (CID 117249504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).