6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine

C14H12BrN3 — CID 115110436

IUPAC6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine
SMILESCn1c(-c2ccc(N)cn2)cc2cc(Br)ccc21
InChIInChI=1S/C14H12BrN3/c1-18-13-5-2-10(15)6-9(13)7-14(18)12-4-3-11(16)8-17-12/h2-8H,16H2,1H3
InChIKeyBPEGGLTVBKURHC-UHFFFAOYSA-N
MW302.18 g/mol
LogP3.59
Rot. Bonds1

About 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine

6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine (PubChem CID 115110436) has the molecular formula C14H12BrN3 and a molecular weight of 302.18 g/mol. Its IUPAC name is 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine
PubChem CID115110436
Molecular FormulaC14H12BrN3
Molecular Weight302.18 g/mol
Exact Mass301.02
IUPAC Name6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine
SMILESCn1c(-c2ccc(N)cn2)cc2cc(Br)ccc21
InChIInChI=1S/C14H12BrN3/c1-18-13-5-2-10(15)6-9(13)7-14(18)12-4-3-11(16)8-17-12/h2-8H,16H2,1H3
InChIKeyBPEGGLTVBKURHC-UHFFFAOYSA-N
XLogP3.59
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.18
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(7-bromo-1-methylindol-2-yl)pyridin-3-amine
CID 115110384
6-(5-bromo-1-benzofuran-2-yl)pyridin-3-amine
CID 115110800
5-bromo-1-methyl-2-(5-methyl-2-pyridinyl)benzimidazole
CID 91644628
6-(6-bromo-1H-indol-3-yl)pyridin-3-amine
CID 115110543
5-(6-bromo-1-methylindol-2-yl)-1,2-oxazol-4-amine
CID 115109324
2,7-dibromo-5-methylindolo[3,2-b]quinoline
CID 10023257
6-(5-amino-2-pyridinyl)pyridin-3-amine;dihydrochloride
CID 11557953
6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]pyridin-3-amine
CID 90184798
2-(5-bromo-1-methylindol-2-yl)-2-hydroxyacetic acid
CID 115072027
6-(5-methoxy-1,2-dimethylindol-3-yl)pyridin-3-amine
CID 115110619
3-(5-bromo-1-methylindol-2-yl)-2,2-dimethylpropanoic acid
CID 117195254
2-(4-bromophenyl)-1-methylbenzimidazol-5-amine
CID 83969010

Frequently Asked Questions

What is the IUPAC name of 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine?
The IUPAC name of 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine (CID 115110436) is 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine?
The canonical SMILES for 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine is Cn1c(-c2ccc(N)cn2)cc2cc(Br)ccc21.
What is the InChIKey of 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine?
The InChIKey is BPEGGLTVBKURHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN3/c1-18-13-5-2-10(15)6-9(13)7-14(18)12-4-3-11(16)8-17-12/h2-8H,16H2,1H3.
What are the key properties of 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine?
6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine has a molecular weight of 302.18 g/mol, XLogP of 3.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-bromo-1-methylindol-2-yl)pyridin-3-amine is sourced from PubChem (CID 115110436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).