(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one

C65H72N10O10S — CID 160940362

IUPAC(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one
SMILESCOc1cc(-c2cc3nn(C)cc3c(O[C@H](C)[C@H]3CCC(=O)C3)n2)cc(OC)c1OC.COc1ccc2[nH]cc(-c3cc4nn(C)cc4c(O[C@H](C)[C@H]4CCC(=O)C4)n3)c2c1.Cc1ccc(-c2cc3nn(C)cc3c(O[C@H](C)[C@H]3CCC(=O)C3)n2)s1
InChIInChI=1S/C23H24N4O3.C23H27N3O5.C19H21N3O2S/c1-13(14-4-5-15(28)8-14)30-23-19-12-27(2)26-22(19)10-21(25-23)18-11-24-20-7-6-16(29-3)9-17(18)20;1-13(14-6-7-16(27)8-14)31-23-17-12-26(2)25-19(17)11-18(24-23)15-9-20(28-3)22(30-5)21(10-15)29-4;1-11-4-7-18(25-11)17-9-16-15(10-22(3)21-16)19(20-17)24-12(2)13-5-6-14(23)8-13/h6-7,9-14,24H,4-5,8H2,1-3H3;9-14H,6-8H2,1-5H3;4,7,9-10,12-13H,5-6,8H2,1-3H3/t2*13-,14+;12-,13+/m111/s1
InChIKeySUKUZHUMGSRTBW-RXIZMMJESA-N
MW1185.42 g/mol
LogP12.20
Rot. Bonds16

About (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one

(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one (PubChem CID 160940362) has the molecular formula C65H72N10O10S and a molecular weight of 1185.42 g/mol. Its IUPAC name is (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one.

Molecular Properties

Compound Name(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one
PubChem CID160940362
Molecular FormulaC65H72N10O10S
Molecular Weight1185.42 g/mol
Exact Mass1184.52
IUPAC Name(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one
SMILESCOc1cc(-c2cc3nn(C)cc3c(O[C@H](C)[C@H]3CCC(=O)C3)n2)cc(OC)c1OC.COc1ccc2[nH]cc(-c3cc4nn(C)cc4c(O[C@H](C)[C@H]4CCC(=O)C4)n3)c2c1.Cc1ccc(-c2cc3nn(C)cc3c(O[C@H](C)[C@H]3CCC(=O)C3)n2)s1
InChIInChI=1S/C23H24N4O3.C23H27N3O5.C19H21N3O2S/c1-13(14-4-5-15(28)8-14)30-23-19-12-27(2)26-22(19)10-21(25-23)18-11-24-20-7-6-16(29-3)9-17(18)20;1-13(14-6-7-16(27)8-14)31-23-17-12-26(2)25-19(17)11-18(24-23)15-9-20(28-3)22(30-5)21(10-15)29-4;1-11-4-7-18(25-11)17-9-16-15(10-22(3)21-16)19(20-17)24-12(2)13-5-6-14(23)8-13/h6-7,9-14,24H,4-5,8H2,1-3H3;9-14H,6-8H2,1-5H3;4,7,9-10,12-13H,5-6,8H2,1-3H3/t2*13-,14+;12-,13+/m111/s1
InChIKeySUKUZHUMGSRTBW-RXIZMMJESA-N
XLogP12.20
TPSA223.74 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds16
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001185.42
LogP ≤ 512.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Analyze (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one 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

ethane;(4R)-4-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]pyrrolidin-2-one;(4R)-4-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]pyrrolidin-2-one
CID 144922940
(3S)-3-[(1R)-1-[6-(6-cyclopropyl-3-pyridinyl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[6-[6-(1-fluoroethyl)-3-pyridinyl]-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[6-(6-methoxy-3H-inden-1-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one
CID 157450163
(3S)-3-[(1R)-1-[6-(6-cyclopropyl-3-pyridinyl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[6-[6-(1-fluoroethyl)-3-pyridinyl]-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one
CID 159924001

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one?
The IUPAC name of (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one (CID 160940362) is (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one.
What is the SMILES notation for (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one?
The canonical SMILES for (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one is COc1cc(-c2cc3nn(C)cc3c(O[C@H](C)[C@H]3CCC(=O)C3)n2)cc(OC)c1OC.COc1ccc2[nH]cc(-c3cc4nn(C)cc4c(O[C@H](C)[C@H]4CCC(=O)C4)n3)c2c1.Cc1ccc(-c2cc3nn(C)cc3c(O[C@H](C)[C@H]3CCC(=O)C3)n2)s1.
What is the InChIKey of (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one?
The InChIKey is SUKUZHUMGSRTBW-RXIZMMJESA-N. The full InChI is InChI=1S/C23H24N4O3.C23H27N3O5.C19H21N3O2S/c1-13(14-4-5-15(28)8-14)30-23-19-12-27(2)26-22(19)10-21(25-23)18-11-24-20-7-6-16(29-3)9-17(18)20;1-13(14-6-7-16(27)8-14)31-23-17-12-26(2)25-19(17)11-18(24-23)15-9-20(28-3)22(30-5)21(10-15)29-4;1-11-4-7-18(25-11)17-9-16-15(10-22(3)21-16)19(20-17)24-12(2)13-5-6-14(23)8-13/h6-7,9-14,24H,4-5,8H2,1-3H3;9-14H,6-8H2,1-5H3;4,7,9-10,12-13H,5-6,8H2,1-3H3/t2*13-,14+;12-,13+/m111/s1.
What are the key properties of (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one?
(3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one has a molecular weight of 1185.42 g/mol, XLogP of 12.20, 16 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[(1R)-1-[6-(5-methoxy-1H-indol-3-yl)-2-methylpyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(5-methylthiophen-2-yl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one;(3S)-3-[(1R)-1-[2-methyl-6-(3,4,5-trimethoxyphenyl)pyrazolo[4,3-c]pyridin-4-yl]oxyethyl]cyclopentan-1-one is sourced from PubChem (CID 160940362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).