6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid

C19H22N4O4 — CID 71292094

IUPAC6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2ccc3c(c2)c(N)c(N(C)C)n3C)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C19H22N4O4/c1-5-10-15(21-17(25)13(16(10)24)19(26)27)9-6-7-12-11(8-9)14(20)18(22(2)3)23(12)4/h6-8H,5,20H2,1-4H3,(H,26,27)(H2,21,24,25)
InChIKeyMYHUHQXCYKWUAC-UHFFFAOYSA-N
MW370.41 g/mol
LogP2.15
Rot. Bonds4

About 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid

6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 71292094) has the molecular formula C19H22N4O4 and a molecular weight of 370.41 g/mol. Its IUPAC name is 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
PubChem CID71292094
Molecular FormulaC19H22N4O4
Molecular Weight370.41 g/mol
Exact Mass370.16
IUPAC Name6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2ccc3c(c2)c(N)c(N(C)C)n3C)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C19H22N4O4/c1-5-10-15(21-17(25)13(16(10)24)19(26)27)9-6-7-12-11(8-9)14(20)18(22(2)3)23(12)4/h6-8H,5,20H2,1-4H3,(H,26,27)(H2,21,24,25)
InChIKeyMYHUHQXCYKWUAC-UHFFFAOYSA-N
XLogP2.15
TPSA124.58 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 52.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid with MolForge

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Related Compounds

6-(3-amino-1-methylindol-5-yl)-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
CID 71292091
6-[2-(diethylaminomethyl)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid;hydrochloride
CID 118951030
5-ethyl-4-hydroxy-6-[2-[[2-methoxyethyl(methyl)amino]methyl]-1-methylindol-5-yl]-2-oxo-1H-pyridine-3-carboxylic acid
CID 71285097
6-[2-(aminomethyl)-1H-indol-6-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid;hydrochloride
CID 118951311
5-ethyl-6-[2-[[ethyl(methyl)amino]methyl]-3-methyl-1H-indol-6-yl]-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
CID 118951347
5-ethyl-4-hydroxy-6-(1H-indazol-6-yl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 71284840
6-[4-(diethylamino)phenyl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
CID 71281794
6-[2-[(cyclopentylamino)methyl]-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid;hydrochloride
CID 71285410
6-[2-[(cyclohexylamino)methyl]-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid;hydrochloride
CID 71284126
5-ethyl-4-hydroxy-6-[1-methyl-2-[[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]methyl]indol-5-yl]-2-oxo-1H-pyridine-3-carboxylic acid
CID 71284821
methyl 5-ethyl-4-hydroxy-6-(9-methyl-5,6,7,8-tetrahydrocarbazol-3-yl)-2-oxo-1H-pyridine-3-carboxylate
CID 71285154
5-ethyl-4-hydroxy-6-[1-methyl-2-[(octylamino)methyl]indol-5-yl]-2-oxo-1H-pyridine-3-carboxylic acid
CID 71284753

Frequently Asked Questions

What is the IUPAC name of 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid (CID 71292094) is 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid is CCc1c(-c2ccc3c(c2)c(N)c(N(C)C)n3C)[nH]c(=O)c(C(=O)O)c1O.
What is the InChIKey of 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is MYHUHQXCYKWUAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4/c1-5-10-15(21-17(25)13(16(10)24)19(26)27)9-6-7-12-11(8-9)14(20)18(22(2)3)23(12)4/h6-8H,5,20H2,1-4H3,(H,26,27)(H2,21,24,25).
What are the key properties of 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 370.41 g/mol, XLogP of 2.15, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-amino-2-(dimethylamino)-1-methylindol-5-yl]-5-ethyl-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 71292094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).