6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

C24H26N6O2 — CID 4320524

IUPAC6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SMILESCCc1cccc2c(C3C(C#N)=C(N)Oc4n[nH]c(C)c43)cn(CC(=O)N3CCCC3)c12
InChIInChI=1S/C24H26N6O2/c1-3-15-7-6-8-16-18(12-30(22(15)16)13-19(31)29-9-4-5-10-29)21-17(11-25)23(26)32-24-20(21)14(2)27-28-24/h6-8,12,21H,3-5,9-10,13,26H2,1-2H3,(H,27,28)
InChIKeyUOCYEIYXTRJXOX-UHFFFAOYSA-N
MW430.51 g/mol
LogP3.08
Rot. Bonds4

About 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (PubChem CID 4320524) has the molecular formula C24H26N6O2 and a molecular weight of 430.51 g/mol. Its IUPAC name is 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.

Molecular Properties

Compound Name6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
PubChem CID4320524
Molecular FormulaC24H26N6O2
Molecular Weight430.51 g/mol
Exact Mass430.21
IUPAC Name6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SMILESCCc1cccc2c(C3C(C#N)=C(N)Oc4n[nH]c(C)c43)cn(CC(=O)N3CCCC3)c12
InChIInChI=1S/C24H26N6O2/c1-3-15-7-6-8-16-18(12-30(22(15)16)13-19(31)29-9-4-5-10-29)21-17(11-25)23(26)32-24-20(21)14(2)27-28-24/h6-8,12,21H,3-5,9-10,13,26H2,1-2H3,(H,27,28)
InChIKeyUOCYEIYXTRJXOX-UHFFFAOYSA-N
XLogP3.08
TPSA112.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 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

2-[3-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-7-ethylindol-1-yl]acetamide
CID 5217490
methyl 2-[3-[(4R)-6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]indol-1-yl]acetate
CID 1096208
6-amino-4-[1-[(2-chlorophenyl)methyl]indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 3996432
(4S)-6-amino-4-[1-[(2-chloro-6-fluorophenyl)methyl]indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 40906052
6-amino-4-[1-[(2-chloro-6-fluorophenyl)methyl]indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 3158951
2-[3-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)indol-1-yl]-N-(3-methoxypropyl)acetamide
CID 5029079
6-amino-3-methyl-4-[1-[2-(2-methylphenoxy)ethyl]indol-3-yl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 3158957
6-amino-3-methyl-4-(4-pyrrolidin-1-ylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 4287209
(4S)-6-amino-3-methyl-4-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 677573
(4S)-6-amino-3-ethyl-4-naphthalen-1-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 9497179
ethyl 2-[(4R)-6-amino-5-cyano-4-(2,6-dichlorophenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
CID 51688507
(4S)-6-amino-4-(6-ethyl-2-oxo-1H-quinolin-3-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 864946

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The IUPAC name of 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (CID 4320524) is 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
What is the SMILES notation for 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The canonical SMILES for 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is CCc1cccc2c(C3C(C#N)=C(N)Oc4n[nH]c(C)c43)cn(CC(=O)N3CCCC3)c12.
What is the InChIKey of 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The InChIKey is UOCYEIYXTRJXOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O2/c1-3-15-7-6-8-16-18(12-30(22(15)16)13-19(31)29-9-4-5-10-29)21-17(11-25)23(26)32-24-20(21)14(2)27-28-24/h6-8,12,21H,3-5,9-10,13,26H2,1-2H3,(H,27,28).
What are the key properties of 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile has a molecular weight of 430.51 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-[7-ethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is sourced from PubChem (CID 4320524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).