8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine

C58H63Cl6FN14S — CID 165035627

IUPAC8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine
SMILESCC1(C)CCN(c2nc(N)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.CC1(N)CCN(c2nc(CF)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.Cc1nc(N2CCC(C)(C)CC2)n2ccnc2c1Sc1cccc(Cl)c1Cl
InChIInChI=1S/C20H22Cl2N4S.C19H20Cl2FN5.C19H21Cl2N5/c1-13-17(27-15-6-4-5-14(21)16(15)22)18-23-9-12-26(18)19(24-13)25-10-7-20(2,3)8-11-25;1-19(23)5-8-26(9-6-19)18-25-14(11-22)15(17-24-7-10-27(17)18)12-3-2-4-13(20)16(12)21;1-19(2)6-9-25(10-7-19)18-24-16(22)14(17-23-8-11-26(17)18)12-4-3-5-13(20)15(12)21/h4-6,9,12H,7-8,10-11H2,1-3H3;2-4,7,10H,5-6,8-9,11,23H2,1H3;3-5,8,11H,6-7,9-10,22H2,1-2H3
InChIKeyNIIWPTWGRXCPMM-UHFFFAOYSA-N
MW1220.02 g/mol
LogP15.52
Rot. Bonds8

About 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine

8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine (PubChem CID 165035627) has the molecular formula C58H63Cl6FN14S and a molecular weight of 1220.02 g/mol. Its IUPAC name is 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine
PubChem CID165035627
Molecular FormulaC58H63Cl6FN14S
Molecular Weight1220.02 g/mol
Exact Mass1216.32
IUPAC Name8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine
SMILESCC1(C)CCN(c2nc(N)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.CC1(N)CCN(c2nc(CF)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.Cc1nc(N2CCC(C)(C)CC2)n2ccnc2c1Sc1cccc(Cl)c1Cl
InChIInChI=1S/C20H22Cl2N4S.C19H20Cl2FN5.C19H21Cl2N5/c1-13-17(27-15-6-4-5-14(21)16(15)22)18-23-9-12-26(18)19(24-13)25-10-7-20(2,3)8-11-25;1-19(23)5-8-26(9-6-19)18-25-14(11-22)15(17-24-7-10-27(17)18)12-3-2-4-13(20)16(12)21;1-19(2)6-9-25(10-7-19)18-24-16(22)14(17-23-8-11-26(17)18)12-4-3-5-13(20)15(12)21/h4-6,9,12H,7-8,10-11H2,1-3H3;2-4,7,10H,5-6,8-9,11,23H2,1H3;3-5,8,11H,6-7,9-10,22H2,1-2H3
InChIKeyNIIWPTWGRXCPMM-UHFFFAOYSA-N
XLogP15.52
TPSA152.33 Ų
H-Bond Donors2
H-Bond Acceptors15
Rotatable Bonds8
Heavy Atoms80
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001220.02
LogP ≤ 515.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1015

Analyze 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine with MolForge

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Related Compounds

(4R)-8-[8-[[6-amino-2-(trifluoromethyl)-3-pyridinyl]sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-[[6-amino-4-(trifluoromethyl)-3-pyridinyl]sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;(4R)-8-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-N-methyl-8-azaspiro[4.5]decan-4-amine;1-[8-(2,3-dichlorophenyl)sulfanylimidazo[1,2-c]pyrimidin-5-yl]-N,4-dimethylpiperidin-4-amine;N,4-dimethyl-1-(8-phenylsulfanylimidazo[1,2-c]pyrimidin-5-yl)piperidin-4-amine
CID 161506461
(5S)-1'-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;(1S)-1'-[7-amino-8-(2,3-dichlorophenyl)sulfanylimidazo[1,2-a]pyridin-5-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;(1S)-1'-[7-amino-8-[[2-(trifluoromethyl)-3-pyridinyl]sulfanyl]imidazo[1,2-a]pyridin-5-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;(5S)-1'-[7-methyl-8-[2-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;(5S)-1'-[7-methyl-8-[[2-(trifluoromethyl)-3-pyridinyl]sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
CID 164986232
(5S)-1'-[8-(2-amino-3-chloro-4-pyridinyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;(1S)-1'-[7-amino-8-(2,3-dichlorophenyl)sulfanylimidazo[1,2-a]pyridin-5-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;(1S)-1'-[7-amino-8-[[2-(trifluoromethyl)-3-pyridinyl]sulfanyl]imidazo[1,2-a]pyridin-5-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;(5S)-1'-[7-methyl-8-[2-(trifluoromethyl)phenyl]imidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;(5S)-1'-[7-methyl-8-[[2-(trifluoromethyl)-3-pyridinyl]sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
CID 165032448
1'-[8-(2,3-Dichlorophenyl)sulfanylimidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]
CID 146482547
(5S)-1'-[8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine
CID 147243740
1'-[8-(2,3-dichlorophenyl)sulfanylimidazo[1,2-c]pyrimidin-5-yl]spiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-imine
CID 153558655
3-azaspiro[5.5]undecane;8-(2,3-dichlorophenyl)sulfanyl-6H-imidazo[1,2-c]pyrimidin-5-one;bis(3-[8-(2,3-dichlorophenyl)sulfanylimidazo[1,2-c]pyrimidin-5-yl]-3-azaspiro[5.5]undecane);methane;molecular nitrogen
CID 157197094
8-(3-Chloro-5-ethenylphenyl)sulfanyl-9-[3-(propan-2-ylamino)propyl]purin-6-amine;8-(3-chloro-5-methylphenyl)sulfanyl-2-fluoro-9-[3-(propan-2-ylamino)propyl]purin-6-amine;8-(3-chloro-5-methylphenyl)sulfanyl-9-[3-(propan-2-ylamino)propyl]purin-6-amine;8-(3-chloro-5-methylphenyl)sulfanyl-9-(2-pyridin-4-ylethyl)purin-6-amine
CID 157287348
8-(2,3-Dichlorophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-(4-ethyl-4-methylpiperidin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-(4-ethyl-4-phenylpiperidin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-(4-methylpiperazin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-(4-methylpiperidin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-(3-methylpyrrolidin-1-yl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)sulfanyl-5-piperidin-1-ylimidazo[1,2-c]pyrimidine
CID 158012807
(4R)-8-[8-(2,3-dichlorophenyl)-7-methylimidazo[1,2-c]pyrimidin-5-yl]-8-azaspiro[4.5]decan-4-amine
CID 158097827
5-chloro-8-(3,4-dichlorophenyl)-7-pyridin-4-ylimidazo[1,2-c]pyrimidine;8-(3,4-dichlorophenyl)-N-[(3S)-3-methyl-1-propan-2-ylpiperidin-3-yl]-7-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-amine;1,1-dimethylcyclohexane
CID 158206248
(5S)-1'-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;(5S)-1'-[8-(2,3-dichlorophenyl)sulfanylimidazo[1,2-c]pyrimidin-5-yl]spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;methane
CID 158416042

Frequently Asked Questions

What is the IUPAC name of 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine?
The IUPAC name of 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine (CID 165035627) is 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine.
What is the SMILES notation for 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine?
The canonical SMILES for 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine is CC1(C)CCN(c2nc(N)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.CC1(N)CCN(c2nc(CF)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.Cc1nc(N2CCC(C)(C)CC2)n2ccnc2c1Sc1cccc(Cl)c1Cl.
What is the InChIKey of 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine?
The InChIKey is NIIWPTWGRXCPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N4S.C19H20Cl2FN5.C19H21Cl2N5/c1-13-17(27-15-6-4-5-14(21)16(15)22)18-23-9-12-26(18)19(24-13)25-10-7-20(2,3)8-11-25;1-19(23)5-8-26(9-6-19)18-25-14(11-22)15(17-24-7-10-27(17)18)12-3-2-4-13(20)16(12)21;1-19(2)6-9-25(10-7-19)18-24-16(22)14(17-23-8-11-26(17)18)12-4-3-5-13(20)15(12)21/h4-6,9,12H,7-8,10-11H2,1-3H3;2-4,7,10H,5-6,8-9,11,23H2,1H3;3-5,8,11H,6-7,9-10,22H2,1-2H3.
What are the key properties of 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine?
8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine has a molecular weight of 1220.02 g/mol, XLogP of 15.52, 8 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)imidazo[1,2-c]pyrimidin-7-amine;1-[8-(2,3-dichlorophenyl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-amine;8-(2,3-dichlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine is sourced from PubChem (CID 165035627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).