N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine

C20H15FN6 — CID 166862856

IUPACN-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
SMILESCc1cc2ccc(-c3ncc(F)c(Nc4ccc5[nH]ncc5c4)n3)cc2[nH]1
InChIInChI=1S/C20H15FN6/c1-11-6-12-2-3-13(8-18(12)24-11)19-22-10-16(21)20(26-19)25-15-4-5-17-14(7-15)9-23-27-17/h2-10,24H,1H3,(H,23,27)(H,22,25,26)
InChIKeySSBLUAPBJIDNHD-UHFFFAOYSA-N
MW358.38 g/mol
LogP4.69
Rot. Bonds3

About N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine

N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine (PubChem CID 166862856) has the molecular formula C20H15FN6 and a molecular weight of 358.38 g/mol. Its IUPAC name is N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine.

Molecular Properties

Compound NameN-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
PubChem CID166862856
Molecular FormulaC20H15FN6
Molecular Weight358.38 g/mol
Exact Mass358.13
IUPAC NameN-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
SMILESCc1cc2ccc(-c3ncc(F)c(Nc4ccc5[nH]ncc5c4)n3)cc2[nH]1
InChIInChI=1S/C20H15FN6/c1-11-6-12-2-3-13(8-18(12)24-11)19-22-10-16(21)20(26-19)25-15-4-5-17-14(7-15)9-23-27-17/h2-10,24H,1H3,(H,23,27)(H,22,25,26)
InChIKeySSBLUAPBJIDNHD-UHFFFAOYSA-N
XLogP4.69
TPSA82.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.38
LogP ≤ 54.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3,4-difluorophenyl)-5-fluoropyrimidin-4-yl]-1H-indazol-5-amine
CID 122589652
N-(2-chloro-5-fluoropyrimidin-4-yl)-1H-indazol-5-amine
CID 22060782
3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one
CID 167202737
N-[6-benzyl-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
CID 146588316
2-(2-ethenyl-1H-indol-6-yl)-4-(1H-indazol-5-ylamino)pyrimidine-5-carbonitrile
CID 167203057
6-[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]-N-pyridazin-4-yl-1H-indole-2-carboxamide
CID 137370324
N-(4-fluorophenyl)-1H-indazol-5-amine
CID 91229030
6-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]-1H-indole-2-carbaldehyde
CID 166920660
N-[2-(2-isoquinolin-3-yl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
CID 137387403
N-[2-[2-[1-[(6-methylpyridazin-4-yl)amino]ethenyl]-1H-indol-6-yl]pyrimidin-4-yl]-1H-indazol-5-amine
CID 167203032
N-(6-ethyl-5-fluoropyrimidin-4-yl)-1H-indazol-5-amine
CID 133416322
N-[(1E,3Z)-1,4-diaminobuta-1,3-dien-2-yl]-6-[4-(1H-indazol-5-ylamino)-5,6-dimethylpyrimidin-2-yl]-1H-indole-2-carboxamide
CID 137381639

Frequently Asked Questions

What is the IUPAC name of N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine?
The IUPAC name of N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine (CID 166862856) is N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine.
What is the SMILES notation for N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine?
The canonical SMILES for N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine is Cc1cc2ccc(-c3ncc(F)c(Nc4ccc5[nH]ncc5c4)n3)cc2[nH]1.
What is the InChIKey of N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine?
The InChIKey is SSBLUAPBJIDNHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN6/c1-11-6-12-2-3-13(8-18(12)24-11)19-22-10-16(21)20(26-19)25-15-4-5-17-14(7-15)9-23-27-17/h2-10,24H,1H3,(H,23,27)(H,22,25,26).
What are the key properties of N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine?
N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine has a molecular weight of 358.38 g/mol, XLogP of 4.69, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine is sourced from PubChem (CID 166862856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).