N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine

C10H10BrN3S — CID 115916939

IUPACN-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine
SMILESCC(Nc1ccccn1)c1ncc(Br)s1
InChIInChI=1S/C10H10BrN3S/c1-7(10-13-6-8(11)15-10)14-9-4-2-3-5-12-9/h2-7H,1H3,(H,12,14)
InChIKeyMIRSJBZTHGNRFF-UHFFFAOYSA-N
MW284.18 g/mol
LogP3.47
Rot. Bonds3

About N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine

N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine (PubChem CID 115916939) has the molecular formula C10H10BrN3S and a molecular weight of 284.18 g/mol. Its IUPAC name is N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine
PubChem CID115916939
Molecular FormulaC10H10BrN3S
Molecular Weight284.18 g/mol
Exact Mass282.98
IUPAC NameN-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine
SMILESCC(Nc1ccccn1)c1ncc(Br)s1
InChIInChI=1S/C10H10BrN3S/c1-7(10-13-6-8(11)15-10)14-9-4-2-3-5-12-9/h2-7H,1H3,(H,12,14)
InChIKeyMIRSJBZTHGNRFF-UHFFFAOYSA-N
XLogP3.47
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.18
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]-6-methylpyridin-2-amine
CID 115917033
N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]-6-methylpyridin-3-amine
CID 115921585
N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]-4-chloroaniline
CID 115921611
N-[1-(1,3-thiazol-5-yl)ethyl]pyridin-2-amine
CID 115916957
N-[1-(3-bromophenyl)ethyl]pyridin-2-amine
CID 60969828
1-(pyridin-2-ylamino)ethanol
CID 20521375
N-[1-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine
CID 115916926
N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
CID 112704501
dichlorocobalt;N-propan-2-ylpyridin-2-amine
CID 175191424
N-[1-(3-methylphenyl)ethyl]pyridin-2-amine
CID 115916909
N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 115769867
N-[(3S)-2,2,4-trimethylpentan-3-yl]pyridin-2-amine
CID 59533491

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine (CID 115916939) is N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine is CC(Nc1ccccn1)c1ncc(Br)s1.
What is the InChIKey of N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine?
The InChIKey is MIRSJBZTHGNRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3S/c1-7(10-13-6-8(11)15-10)14-9-4-2-3-5-12-9/h2-7H,1H3,(H,12,14).
What are the key properties of N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine?
N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine has a molecular weight of 284.18 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-bromo-1,3-thiazol-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 115916939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).