3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide

C24H22N8O2 — CID 177283565

IUPAC3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide
SMILESCc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCc3nccn3C)n2)nc(C(N)=O)c1N
InChIInChI=1S/C24H22N8O2/c1-13-6-7-16-15(11-28-31-16)21(13)14-10-18(30-23(22(14)25)24(26)33)17-4-3-5-20(29-17)34-12-19-27-8-9-32(19)2/h3-11H,12,25H2,1-2H3,(H2,26,33)(H,28,31)
InChIKeyYSYZUBBBZPBHGZ-UHFFFAOYSA-N
MW454.49 g/mol
LogP2.99
Rot. Bonds6

About 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide

3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide (PubChem CID 177283565) has the molecular formula C24H22N8O2 and a molecular weight of 454.49 g/mol. Its IUPAC name is 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide
PubChem CID177283565
Molecular FormulaC24H22N8O2
Molecular Weight454.49 g/mol
Exact Mass454.19
IUPAC Name3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide
SMILESCc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCc3nccn3C)n2)nc(C(N)=O)c1N
InChIInChI=1S/C24H22N8O2/c1-13-6-7-16-15(11-28-31-16)21(13)14-10-18(30-23(22(14)25)24(26)33)17-4-3-5-20(29-17)34-12-19-27-8-9-32(19)2/h3-11H,12,25H2,1-2H3,(H2,26,33)(H,28,31)
InChIKeyYSYZUBBBZPBHGZ-UHFFFAOYSA-N
XLogP2.99
TPSA150.62 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.49
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Related Compounds

3-((2S)-2-amino-3-(2-amino-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propyl)-1H-indole-2-carboxamide
CID 46226156
7-(furan-2-yl)-3-(1H-indazol-5-ylmethyl)triazolo[4,5-d]pyrimidin-5-amine
CID 21874662
N-[1-[[6-(2-aminoethoxy)-2-pyridinyl]methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 67259274
N-[1-[[6-(3-aminopropoxy)-2-pyridinyl]methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 67259421
N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 67260539
N-(3-ethyl-1-((6-(2-(piperazin-1-yl)ethoxy)pyridin-2-yl)methyl)-1H-indazol-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 70814921
7-(furan-3-yl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-3H-imidazo[4,5-c]pyridine
CID 136273272
N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 136643019
5-[3-[4-(furan-3-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-N-propan-2-ylpyridin-3-amine
CID 137019320
N-[5-[3-[4-(furan-3-yl)-1H-benzimidazol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]-3-methylbutanamide
CID 137055116
N-[5-[3-[4-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-3,3-dimethylbutanamide
CID 137111575
US11535621, Example 231
CID 155598627

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide (CID 177283565) is 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide is Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCc3nccn3C)n2)nc(C(N)=O)c1N.
What is the InChIKey of 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide?
The InChIKey is YSYZUBBBZPBHGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N8O2/c1-13-6-7-16-15(11-28-31-16)21(13)14-10-18(30-23(22(14)25)24(26)33)17-4-3-5-20(29-17)34-12-19-27-8-9-32(19)2/h3-11H,12,25H2,1-2H3,(H2,26,33)(H,28,31).
What are the key properties of 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide?
3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide has a molecular weight of 454.49 g/mol, XLogP of 2.99, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-[6-[(1-methylimidazol-2-yl)methoxy]-2-pyridinyl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 177283565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).