N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine

C14H11BrN6 — CID 79165280

IUPACN-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine
SMILESBrc1cn2c(CNc3cccc4cn[nH]c34)cnc2cn1
InChIInChI=1S/C14H11BrN6/c15-12-8-21-10(6-18-13(21)7-17-12)5-16-11-3-1-2-9-4-19-20-14(9)11/h1-4,6-8,16H,5H2,(H,19,20)
InChIKeyFGUWLQJEZILPPD-UHFFFAOYSA-N
MW343.19 g/mol
LogP2.98
Rot. Bonds3

About N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine

N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine (PubChem CID 79165280) has the molecular formula C14H11BrN6 and a molecular weight of 343.19 g/mol. Its IUPAC name is N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine.

Molecular Properties

Compound NameN-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine
PubChem CID79165280
Molecular FormulaC14H11BrN6
Molecular Weight343.19 g/mol
Exact Mass342.02
IUPAC NameN-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine
SMILESBrc1cn2c(CNc3cccc4cn[nH]c34)cnc2cn1
InChIInChI=1S/C14H11BrN6/c15-12-8-21-10(6-18-13(21)7-17-12)5-16-11-3-1-2-9-4-19-20-14(9)11/h1-4,6-8,16H,5H2,(H,19,20)
InChIKeyFGUWLQJEZILPPD-UHFFFAOYSA-N
XLogP2.98
TPSA70.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.19
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,3-difluoroaniline
CID 79164556
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2,6-dichloroaniline
CID 79164376
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-5-chloro-2-fluoroaniline
CID 79175921
4-bromo-N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-2-fluoroaniline
CID 79177055
N-[(2-bromophenyl)methyl]-1H-indazol-7-amine
CID 43730933
N-[(1-ethylpyrrol-2-yl)methyl]-1H-indazol-7-amine
CID 66411940
N-(1,3-thiazol-2-ylmethyl)-1H-indazol-7-amine
CID 63657431
N-benzyl-1H-indazol-7-amine
CID 43730923
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-5-chloro-2-methylaniline
CID 79175722
N-(thiadiazol-4-ylmethyl)-1H-indazol-7-amine
CID 43731041
2-[[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]methyl]phenol
CID 114331591
N-[(3-chloro-4-fluorophenyl)methyl]-1H-indazol-7-amine
CID 81145361

Frequently Asked Questions

What is the IUPAC name of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine?
The IUPAC name of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine (CID 79165280) is N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine.
What is the SMILES notation for N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine?
The canonical SMILES for N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine is Brc1cn2c(CNc3cccc4cn[nH]c34)cnc2cn1.
What is the InChIKey of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine?
The InChIKey is FGUWLQJEZILPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN6/c15-12-8-21-10(6-18-13(21)7-17-12)5-16-11-3-1-2-9-4-19-20-14(9)11/h1-4,6-8,16H,5H2,(H,19,20).
What are the key properties of N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine?
N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine has a molecular weight of 343.19 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methyl]-1H-indazol-7-amine is sourced from PubChem (CID 79165280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).