6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide

C15H20N2O2 — CID 22143555

IUPAC6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide
SMILESCc1c(C(=O)NCC(C)C)c2ccc(O)cc2n1C
InChIInChI=1S/C15H20N2O2/c1-9(2)8-16-15(19)14-10(3)17(4)13-7-11(18)5-6-12(13)14/h5-7,9,18H,8H2,1-4H3,(H,16,19)
InChIKeyYEDLUSPFNVLIRI-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.58
Rot. Bonds3

About 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide

6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide (PubChem CID 22143555) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide.

Molecular Properties

Compound Name6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide
PubChem CID22143555
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide
SMILESCc1c(C(=O)NCC(C)C)c2ccc(O)cc2n1C
InChIInChI=1S/C15H20N2O2/c1-9(2)8-16-15(19)14-10(3)17(4)13-7-11(18)5-6-12(13)14/h5-7,9,18H,8H2,1-4H3,(H,16,19)
InChIKeyYEDLUSPFNVLIRI-UHFFFAOYSA-N
XLogP2.58
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-Hydroxy-1H-indole-3-carboxaldehyde
CID 10103438
6-hydroxytryprostatin B
CID 71296150
6-Hydroxy-1H-Indole-3-Acetamide
CID 286538
1-(oxan-4-ylmethyl)-3-[(2,2,3,3-tetramethylcyclopropyl)carbonyl]-1H-indol-6-ol
CID 11559474
(2R)-2-amino-6-[[2-(6-hydroxy-1H-indol-3-yl)-2-oxoacetyl]amino]hexanoic acid
CID 71450757
6-Hydroxy-3,13,21-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2(10),4(9),5,7,15,17,19-octaen-14-one
CID 136734737
2-(4-benzylpiperidin-1-yl)-1-(6-hydroxy-1H-indol-3-yl)ethanone
CID 56835060
(2R)-5-(diaminomethylideneamino)-2-[[2-(6-hydroxy-1H-indol-3-yl)-2-oxoacetyl]amino]pentanoic acid
CID 71461523
6-hydroxy-2-{[6-hydroxy-1-methyl-3-(phenylcarbamoyl)-1H-indol-2-yl]disulfanyl}-1-methyl-N-phenyl-1H-indole-3-carboxamide
CID 5328611
1,2,3,4-Tetrahydro pyrido[3,4-b]indole 26
CID 6539941
1-benzyl-N-(3,4-difluorobenzyl)-6-ethoxy-2-isopropyl-1H-indole-3-carboxamide
CID 25059487
1-Benzyl-N-(3,4-difluorobenzyl)-2-isopropyl-6-propoxy-1H-indole-3-carboxamide
CID 25059488

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide?
The IUPAC name of 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide (CID 22143555) is 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide.
What is the SMILES notation for 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide?
The canonical SMILES for 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide is Cc1c(C(=O)NCC(C)C)c2ccc(O)cc2n1C.
What is the InChIKey of 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide?
The InChIKey is YEDLUSPFNVLIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-9(2)8-16-15(19)14-10(3)17(4)13-7-11(18)5-6-12(13)14/h5-7,9,18H,8H2,1-4H3,(H,16,19).
What are the key properties of 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide?
6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1,2-dimethyl-N-(2-methylpropyl)indole-3-carboxamide is sourced from PubChem (CID 22143555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).