N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine

C14H12BrN5 — CID 166397784

IUPACN-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine
SMILESBrc1cnc(C2CC2)nc1Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C14H12BrN5/c15-11-7-16-13(8-1-2-8)19-14(11)18-10-3-4-12-9(5-10)6-17-20-12/h3-8H,1-2H2,(H,17,20)(H,16,18,19)
InChIKeyJUAXRGYABHCGGB-UHFFFAOYSA-N
MW330.19 g/mol
LogP3.74
Rot. Bonds3

About N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine

N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine (PubChem CID 166397784) has the molecular formula C14H12BrN5 and a molecular weight of 330.19 g/mol. Its IUPAC name is N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine.

Molecular Properties

Compound NameN-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine
PubChem CID166397784
Molecular FormulaC14H12BrN5
Molecular Weight330.19 g/mol
Exact Mass329.03
IUPAC NameN-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine
SMILESBrc1cnc(C2CC2)nc1Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C14H12BrN5/c15-11-7-16-13(8-1-2-8)19-14(11)18-10-3-4-12-9(5-10)6-17-20-12/h3-8H,1-2H2,(H,17,20)(H,16,18,19)
InChIKeyJUAXRGYABHCGGB-UHFFFAOYSA-N
XLogP3.74
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.19
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-1H-indazol-5-amine
CID 91229030
6-bromo-N-(1H-indazol-5-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 166397780
N-(2-chloro-5-fluoropyrimidin-4-yl)-1H-indazol-5-amine
CID 22060782
N-[(4-cyclopropylphenyl)methyl]-1H-indazol-5-amine
CID 79968714
N-(1H-indazol-5-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 78324014
2-N-cyclopentyl-4-N-(1H-indazol-5-yl)thieno[3,2-d]pyrimidine-2,4-diamine
CID 59130365
2-chloro-4-(1H-indazol-5-ylamino)pyrimidine-5-carbonitrile
CID 170994334
N-[2-(3,4-difluorophenyl)-5-fluoropyrimidin-4-yl]-1H-indazol-5-amine
CID 122589652
N-(6-ethyl-5-fluoropyrimidin-4-yl)-1H-indazol-5-amine
CID 133416322
N-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-indazol-5-amine
CID 43690947
N-(piperidin-2-ylmethyl)-1H-indazol-5-amine
CID 106633290
N-(3-methyl-5-nitro-2-pyridinyl)-1H-indazol-5-amine
CID 133425970

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine?
The IUPAC name of N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine (CID 166397784) is N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine.
What is the SMILES notation for N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine?
The canonical SMILES for N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine is Brc1cnc(C2CC2)nc1Nc1ccc2[nH]ncc2c1.
What is the InChIKey of N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine?
The InChIKey is JUAXRGYABHCGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN5/c15-11-7-16-13(8-1-2-8)19-14(11)18-10-3-4-12-9(5-10)6-17-20-12/h3-8H,1-2H2,(H,17,20)(H,16,18,19).
What are the key properties of N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine?
N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine has a molecular weight of 330.19 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-cyclopropylpyrimidin-4-yl)-1H-indazol-5-amine is sourced from PubChem (CID 166397784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).