N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine

C11H15BrN4 — CID 63024140

IUPACN-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1nc2ncc(Br)cc2[nH]1
InChIInChI=1S/C11H15BrN4/c1-3-4-13-7(2)10-15-9-5-8(12)6-14-11(9)16-10/h5-7,13H,3-4H2,1-2H3,(H,14,15,16)
InChIKeyDXKIPCHNRBAHLN-UHFFFAOYSA-N
MW283.17 g/mol
LogP2.78
Rot. Bonds4

About N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine

N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine (PubChem CID 63024140) has the molecular formula C11H15BrN4 and a molecular weight of 283.17 g/mol. Its IUPAC name is N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine
PubChem CID63024140
Molecular FormulaC11H15BrN4
Molecular Weight283.17 g/mol
Exact Mass282.05
IUPAC NameN-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1nc2ncc(Br)cc2[nH]1
InChIInChI=1S/C11H15BrN4/c1-3-4-13-7(2)10-15-9-5-8(12)6-14-11(9)16-10/h5-7,13H,3-4H2,1-2H3,(H,14,15,16)
InChIKeyDXKIPCHNRBAHLN-UHFFFAOYSA-N
XLogP2.78
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.17
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-N-ethylethanamine
CID 62328822
2-amino-1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethanol
CID 66166285
N-[1-(5-bromo-1H-imidazol-2-yl)ethyl]propan-1-amine
CID 123282366
6-bromo-2-undecyl-1H-imidazo[4,5-b]pyridine
CID 65426544
7-bromo-3-ethyl-1H-pyrido[2,3-b]pyrazin-2-one
CID 168984379
6-bromo-2-(2,3,3-trimethylbutyl)-1H-imidazo[4,5-b]pyridine
CID 55260714
6-bromo-2-(2,4,4-trimethylpentyl)-1H-imidazo[4,5-b]pyridine
CID 55188420
N-[1-(1,6,7,8-tetrahydro-[1,4]dioxepino[2,3-f]benzimidazol-2-yl)ethyl]propan-1-amine
CID 63023474
[(1R)-1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl] furan-2-carboxylate
CID 95310017
(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)methyl 3-methylbutanoate
CID 56805941
3-(5-bromopyrimidin-2-yl)-N-propylbutan-2-amine
CID 63873435
[(1S)-1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl] 5-propan-2-yloxypyridine-3-carboxylate
CID 97085437

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine (CID 63024140) is N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine is CCCNC(C)c1nc2ncc(Br)cc2[nH]1.
What is the InChIKey of N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine?
The InChIKey is DXKIPCHNRBAHLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN4/c1-3-4-13-7(2)10-15-9-5-8(12)6-14-11(9)16-10/h5-7,13H,3-4H2,1-2H3,(H,14,15,16).
What are the key properties of N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine?
N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine has a molecular weight of 283.17 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 63024140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).