7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine

C20H21FN6 — CID 142683030

IUPAC7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine
SMILESCCCc1c(CCn2ccnc2-c2cccc(F)n2)ncn2cnc(C)c12
InChIInChI=1S/C20H21FN6/c1-3-5-15-16(24-13-27-12-23-14(2)19(15)27)8-10-26-11-9-22-20(26)17-6-4-7-18(21)25-17/h4,6-7,9,11-13H,3,5,8,10H2,1-2H3
InChIKeyGFQKJBZVYUNYGM-UHFFFAOYSA-N
MW364.43 g/mol
LogP3.63
Rot. Bonds6

About 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine

7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine (PubChem CID 142683030) has the molecular formula C20H21FN6 and a molecular weight of 364.43 g/mol. Its IUPAC name is 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine.

Molecular Properties

Compound Name7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine
PubChem CID142683030
Molecular FormulaC20H21FN6
Molecular Weight364.43 g/mol
Exact Mass364.18
IUPAC Name7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine
SMILESCCCc1c(CCn2ccnc2-c2cccc(F)n2)ncn2cnc(C)c12
InChIInChI=1S/C20H21FN6/c1-3-5-15-16(24-13-27-12-23-14(2)19(15)27)8-10-26-11-9-22-20(26)17-6-4-7-18(21)25-17/h4,6-7,9,11-13H,3,5,8,10H2,1-2H3
InChIKeyGFQKJBZVYUNYGM-UHFFFAOYSA-N
XLogP3.63
TPSA60.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

7-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-5-methyl-8-propylimidazo[1,2-c]pyrimidine
CID 11245036
6-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-1-methyl-5-propylimidazo[1,5-a]pyrazine
CID 58748663
ethyl 7-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine-3-carboxylate
CID 11189011
5-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-propylpyrazin-2-amine
CID 58748668
2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine
CID 22335093
6-chloro-N,N-diethyl-3-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]pyridazin-4-amine
CID 10451188
2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride
CID 70011500
5-ethyl-6-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
CID 22335063
6-[1-[[2-(methoxymethyl)-8-propyl-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]methyl]imidazol-2-yl]pyridine-2-carbonitrile
CID 11280682
7-[[2-(3-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-8-propyl-[1,2,4]triazolo[1,5-c]pyrimidine
CID 11427692
(1E,3Z)-5-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]-1-methoxy-3-propylpenta-1,3-diene-1,4-diamine
CID 142879975
2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-1-propylbenzimidazole-5-carbohydrazide
CID 22379986

Frequently Asked Questions

What is the IUPAC name of 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine?
The IUPAC name of 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine (CID 142683030) is 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine.
What is the SMILES notation for 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine?
The canonical SMILES for 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine is CCCc1c(CCn2ccnc2-c2cccc(F)n2)ncn2cnc(C)c12.
What is the InChIKey of 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine?
The InChIKey is GFQKJBZVYUNYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN6/c1-3-5-15-16(24-13-27-12-23-14(2)19(15)27)8-10-26-11-9-22-20(26)17-6-4-7-18(21)25-17/h4,6-7,9,11-13H,3,5,8,10H2,1-2H3.
What are the key properties of 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine?
7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine has a molecular weight of 364.43 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine is sourced from PubChem (CID 142683030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).