N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine

C12H10BrN5 — CID 152552554

IUPACN-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine
SMILESCn1ncc2cc(Nc3ncc(Br)cn3)ccc21
InChIInChI=1S/C12H10BrN5/c1-18-11-3-2-10(4-8(11)5-16-18)17-12-14-6-9(13)7-15-12/h2-7H,1H3,(H,14,15,17)
InChIKeyYNUDHXPFCPFXGG-UHFFFAOYSA-N
MW304.15 g/mol
LogP2.87
Rot. Bonds2

About N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine

N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine (PubChem CID 152552554) has the molecular formula C12H10BrN5 and a molecular weight of 304.15 g/mol. Its IUPAC name is N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine.

Molecular Properties

Compound NameN-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine
PubChem CID152552554
Molecular FormulaC12H10BrN5
Molecular Weight304.15 g/mol
Exact Mass303.01
IUPAC NameN-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine
SMILESCn1ncc2cc(Nc3ncc(Br)cn3)ccc21
InChIInChI=1S/C12H10BrN5/c1-18-11-3-2-10(4-8(11)5-16-18)17-12-14-6-9(13)7-15-12/h2-7H,1H3,(H,14,15,17)
InChIKeyYNUDHXPFCPFXGG-UHFFFAOYSA-N
XLogP2.87
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.15
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

dihydroxy-methyl-[2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]azanium
CID 123725394
N-tert-butyl-1-methylindazol-5-amine
CID 58709852
4-[[5-methyl-4-[(1-methylindazol-5-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide
CID 67047282
4-N-(3-aminopropyl)-5-cyclopropyl-2-N-(1-methylindazol-5-yl)pyrimidine-2,4-diamine
CID 68624563
N-(1-methylindazol-5-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134198363
5-bromo-N-(3,5-dimethylphenyl)pyrimidin-2-amine
CID 63874390
3-methyl-N-(1-methylindazol-5-yl)-2H-pyrazolo[4,3-c]pyridin-4-amine
CID 59618868
1-methyl-N-(4-methylcyclohexyl)indazol-5-amine
CID 59514269
1,5-dimethylindazole;ethane
CID 90788862
4-[[2-[(1-methylindazol-5-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]amino]cyclohexan-1-ol
CID 59276639
1-methyl-N-(2-methylcyclohexyl)indazol-5-amine
CID 59514198
1-methyl-N-[4-[4-(trifluoromethyl)piperidin-1-yl]phenyl]indazol-5-amine
CID 167300671

Frequently Asked Questions

What is the IUPAC name of N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine?
The IUPAC name of N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine (CID 152552554) is N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine.
What is the SMILES notation for N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine?
The canonical SMILES for N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine is Cn1ncc2cc(Nc3ncc(Br)cn3)ccc21.
What is the InChIKey of N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine?
The InChIKey is YNUDHXPFCPFXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN5/c1-18-11-3-2-10(4-8(11)5-16-18)17-12-14-6-9(13)7-15-12/h2-7H,1H3,(H,14,15,17).
What are the key properties of N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine?
N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine has a molecular weight of 304.15 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromopyrimidin-2-yl)-1-methylindazol-5-amine is sourced from PubChem (CID 152552554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).