5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine

C10H10BrFN4 — CID 104923734

IUPAC5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine
SMILESFc1cc(Br)cnc1NCCn1ccnc1
InChIInChI=1S/C10H10BrFN4/c11-8-5-9(12)10(15-6-8)14-2-4-16-3-1-13-7-16/h1,3,5-7H,2,4H2,(H,14,15)
InChIKeyWMQIRPWYPXDDDV-UHFFFAOYSA-N
MW285.12 g/mol
LogP2.29
Rot. Bonds4

About 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine

5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine (PubChem CID 104923734) has the molecular formula C10H10BrFN4 and a molecular weight of 285.12 g/mol. Its IUPAC name is 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine
PubChem CID104923734
Molecular FormulaC10H10BrFN4
Molecular Weight285.12 g/mol
Exact Mass284.01
IUPAC Name5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine
SMILESFc1cc(Br)cnc1NCCn1ccnc1
InChIInChI=1S/C10H10BrFN4/c11-8-5-9(12)10(15-6-8)14-2-4-16-3-1-13-7-16/h1,3,5-7H,2,4H2,(H,14,15)
InChIKeyWMQIRPWYPXDDDV-UHFFFAOYSA-N
XLogP2.29
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.12
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-3-fluoro-N-(2-pyrazol-1-ylethyl)pyridin-2-amine
CID 104918929
2-N-(2-imidazol-1-ylethyl)-5-methylpyridine-2,3-diamine
CID 66280404
5-bromo-3-fluoro-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
CID 104924181
5-bromo-N-(2-imidazol-1-ylethyl)-2-(methylamino)pyridine-3-carboxamide
CID 62176435
5-bromo-3-fluoro-N-[(E)-pent-3-enyl]pyridin-2-amine
CID 104924312
N-(5-bromo-3-fluoro-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 104923678
5-bromo-3-fluoro-N-(2-methylsulfanylethyl)pyridin-2-amine
CID 104923732
5-amino-2-(2-imidazol-1-ylethylamino)pyridine-3-carboxamide
CID 61358020
5-bromo-N-(1-imidazol-1-ylpropan-2-yl)-3-methylpyridin-2-amine
CID 79718384
3,5-difluoro-6-hydrazinyl-N-(3-imidazol-1-ylpropyl)pyridin-2-amine
CID 114073280
N-(2-imidazol-1-ylethyl)-5-methyl-3-nitropyridin-2-amine
CID 66280700
3-fluoro-N-(2-imidazol-1-ylethyl)aniline
CID 62564347

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine (CID 104923734) is 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine is Fc1cc(Br)cnc1NCCn1ccnc1.
What is the InChIKey of 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine?
The InChIKey is WMQIRPWYPXDDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrFN4/c11-8-5-9(12)10(15-6-8)14-2-4-16-3-1-13-7-16/h1,3,5-7H,2,4H2,(H,14,15).
What are the key properties of 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine?
5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine has a molecular weight of 285.12 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-fluoro-N-(2-imidazol-1-ylethyl)pyridin-2-amine is sourced from PubChem (CID 104923734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).