2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide

C24H28FN7O2 — CID 167501418

IUPAC2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide
SMILESCCn1cc2c(N3CC[C@H](NC)C3)cc(OC)c(C(=O)Nc3cc(F)c4nc(C)cn4c3)c2n1
InChIInChI=1S/C24H28FN7O2/c1-5-32-13-17-19(30-7-6-15(11-30)26-3)9-20(34-4)21(22(17)29-32)24(33)28-16-8-18(25)23-27-14(2)10-31(23)12-16/h8-10,12-13,15,26H,5-7,11H2,1-4H3,(H,28,33)/t15-/m0/s1
InChIKeyQJEWRPJYDICTMS-HNNXBMFYSA-N
MW465.53 g/mol
LogP3.21
Rot. Bonds6

About 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide

2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide (PubChem CID 167501418) has the molecular formula C24H28FN7O2 and a molecular weight of 465.53 g/mol. Its IUPAC name is 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide
PubChem CID167501418
Molecular FormulaC24H28FN7O2
Molecular Weight465.53 g/mol
Exact Mass465.23
IUPAC Name2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide
SMILESCCn1cc2c(N3CC[C@H](NC)C3)cc(OC)c(C(=O)Nc3cc(F)c4nc(C)cn4c3)c2n1
InChIInChI=1S/C24H28FN7O2/c1-5-32-13-17-19(30-7-6-15(11-30)26-3)9-20(34-4)21(22(17)29-32)24(33)28-16-8-18(25)23-27-14(2)10-31(23)12-16/h8-10,12-13,15,26H,5-7,11H2,1-4H3,(H,28,33)/t15-/m0/s1
InChIKeyQJEWRPJYDICTMS-HNNXBMFYSA-N
XLogP3.21
TPSA88.72 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.53
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide with MolForge

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Related Compounds

2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-[(3R)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide
CID 167502145
[(3R)-1-[2-ethyl-7-[(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)carbamoyl]indazol-4-yl]pyrrolidin-3-yl] N-methylcarbamate
CID 176741432
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-methoxy-8-[(3R)-3-(methylamino)pyrrolidin-1-yl]quinoxaline-5-carboxamide
CID 167500194
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-8-[(3R)-3-(methylamino)pyrrolidin-1-yl]quinoxaline-5-carboxamide
CID 167500253
4-[(3S)-3-[(1-cyanocyclopropyl)amino]pyrrolidin-1-yl]-6-fluoro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-methylindazole-7-carboxamide
CID 167501936
tert-butyl N-[1-[7-[(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)carbamoyl]-2-(2-methoxyethyl)indazol-4-yl]pyrrolidin-3-yl]carbamate
CID 167500915
2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-piperazin-1-ylindazole-7-carboxamide;propane
CID 167500912
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-[(3R)-3-[(3-methoxycyclobutyl)amino]pyrrolidin-1-yl]-2-methylindazole-7-carboxamide
CID 167501548
2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-(3-oxo-5,6,8,8a-tetrahydro-1H-[1,3]oxazolo[3,4-a]pyrazin-7-yl)indazole-7-carboxamide
CID 167502177
4-[(9aR)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazin-8-yl]-2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)indazole-7-carboxamide
CID 167501775
4-(4-amino-4-ethylpiperidin-1-yl)-2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)indazole-7-carboxamide
CID 167500947
4-[(3R)-3-(cyclobutylamino)pyrrolidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-methylindazole-7-carboxamide
CID 167502110

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide?
The IUPAC name of 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide (CID 167501418) is 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide.
What is the SMILES notation for 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide?
The canonical SMILES for 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide is CCn1cc2c(N3CC[C@H](NC)C3)cc(OC)c(C(=O)Nc3cc(F)c4nc(C)cn4c3)c2n1.
What is the InChIKey of 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide?
The InChIKey is QJEWRPJYDICTMS-HNNXBMFYSA-N. The full InChI is InChI=1S/C24H28FN7O2/c1-5-32-13-17-19(30-7-6-15(11-30)26-3)9-20(34-4)21(22(17)29-32)24(33)28-16-8-18(25)23-27-14(2)10-31(23)12-16/h8-10,12-13,15,26H,5-7,11H2,1-4H3,(H,28,33)/t15-/m0/s1.
What are the key properties of 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide?
2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide has a molecular weight of 465.53 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-methoxy-4-[(3S)-3-(methylamino)pyrrolidin-1-yl]indazole-7-carboxamide is sourced from PubChem (CID 167501418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).