4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine

C30H30FN9O2 — CID 72526319

IUPAC4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine
SMILESCOc1cc(-c2nc(-c3ccc(F)cc3)[nH]c2-c2ccnc(Nc3ccc(N4CC(C)OC(C)C4)nc3)n2)cnc1N
InChIInChI=1S/C30H30FN9O2/c1-17-15-40(16-18(2)42-17)25-9-8-22(14-34-25)36-30-33-11-10-23(37-30)27-26(20-12-24(41-3)28(32)35-13-20)38-29(39-27)19-4-6-21(31)7-5-19/h4-14,17-18H,15-16H2,1-3H3,(H2,32,35)(H,38,39)(H,33,36,37)
InChIKeyRJGPTRUUICNSNB-UHFFFAOYSA-N
MW567.63 g/mol
LogP5.08
Rot. Bonds7

About 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine

4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine (PubChem CID 72526319) has the molecular formula C30H30FN9O2 and a molecular weight of 567.63 g/mol. Its IUPAC name is 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine
PubChem CID72526319
Molecular FormulaC30H30FN9O2
Molecular Weight567.63 g/mol
Exact Mass567.25
IUPAC Name4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine
SMILESCOc1cc(-c2nc(-c3ccc(F)cc3)[nH]c2-c2ccnc(Nc3ccc(N4CC(C)OC(C)C4)nc3)n2)cnc1N
InChIInChI=1S/C30H30FN9O2/c1-17-15-40(16-18(2)42-17)25-9-8-22(14-34-25)36-30-33-11-10-23(37-30)27-26(20-12-24(41-3)28(32)35-13-20)38-29(39-27)19-4-6-21(31)7-5-19/h4-14,17-18H,15-16H2,1-3H3,(H2,32,35)(H,38,39)(H,33,36,37)
InChIKeyRJGPTRUUICNSNB-UHFFFAOYSA-N
XLogP5.08
TPSA139.99 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500567.63
LogP ≤ 55.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Gdc-0425
CID 58266779
4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(2-morpholin-4-ylphenyl)pyridin-2-amine
CID 44521020
4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-N-(3-morpholin-4-ylphenyl)pyridin-2-amine
CID 44521022
4-(5,6-Dimethyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(4-morpholin-4-ylphenyl)pyridin-2-amine
CID 44521024
N-{4-[3-(5-methoxypyridin-2-yl)-1H-pyrrolo[3,2-b]pyridin-2-yl]pyridin-2-yl}acetamide
CID 121411739
6-[[[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-4-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 10256734
1-[3-(6-fluoro-1H-benzimidazol-2-yl)-5-(3-fluoro-5-methoxyphenyl)-4-pyridinyl]piperidin-4-amine
CID 118057675
US9765058, Example 2-2-10
CID 86580572
3-(5-ethoxy-2-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine
CID 71520979
N-[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]-6-(1H-pyrrolo[2,3-c]pyridin-3-yl)pyrimidin-4-amine
CID 118735323
8-ethoxy-4-(4-pyridin-2-ylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
CID 663751
2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-(2-phenylethoxy)-1H-imidazo[4,5-b]pyridine
CID 10172593

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine?
The IUPAC name of 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine (CID 72526319) is 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine.
What is the SMILES notation for 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine?
The canonical SMILES for 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine is COc1cc(-c2nc(-c3ccc(F)cc3)[nH]c2-c2ccnc(Nc3ccc(N4CC(C)OC(C)C4)nc3)n2)cnc1N.
What is the InChIKey of 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine?
The InChIKey is RJGPTRUUICNSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30FN9O2/c1-17-15-40(16-18(2)42-17)25-9-8-22(14-34-25)36-30-33-11-10-23(37-30)27-26(20-12-24(41-3)28(32)35-13-20)38-29(39-27)19-4-6-21(31)7-5-19/h4-14,17-18H,15-16H2,1-3H3,(H2,32,35)(H,38,39)(H,33,36,37).
What are the key properties of 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine?
4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine has a molecular weight of 567.63 g/mol, XLogP of 5.08, 7 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-5-yl]-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]pyrimidin-2-amine is sourced from PubChem (CID 72526319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).