5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide

C19H21N5O3 — CID 69312789

IUPAC5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide
SMILESCc1c(C)n(C(N)=O)c2ccc(Oc3ccnc(NC(=O)N(C)C)c3)cc12
InChIInChI=1S/C19H21N5O3/c1-11-12(2)24(18(20)25)16-6-5-13(9-15(11)16)27-14-7-8-21-17(10-14)22-19(26)23(3)4/h5-10H,1-4H3,(H2,20,25)(H,21,22,26)
InChIKeyTXOKPCVLYIAGPL-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.47
Rot. Bonds3

About 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide

5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide (PubChem CID 69312789) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide.

Molecular Properties

Compound Name5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide
PubChem CID69312789
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide
SMILESCc1c(C)n(C(N)=O)c2ccc(Oc3ccnc(NC(=O)N(C)C)c3)cc12
InChIInChI=1S/C19H21N5O3/c1-11-12(2)24(18(20)25)16-6-5-13(9-15(11)16)27-14-7-8-21-17(10-14)22-19(26)23(3)4/h5-10H,1-4H3,(H2,20,25)(H,21,22,26)
InChIKeyTXOKPCVLYIAGPL-UHFFFAOYSA-N
XLogP3.47
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide?
The IUPAC name of 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide (CID 69312789) is 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide.
What is the SMILES notation for 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide?
The canonical SMILES for 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide is Cc1c(C)n(C(N)=O)c2ccc(Oc3ccnc(NC(=O)N(C)C)c3)cc12.
What is the InChIKey of 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide?
The InChIKey is TXOKPCVLYIAGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-11-12(2)24(18(20)25)16-6-5-13(9-15(11)16)27-14-7-8-21-17(10-14)22-19(26)23(3)4/h5-10H,1-4H3,(H2,20,25)(H,21,22,26).
What are the key properties of 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide?
5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 3.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-(dimethylcarbamoylamino)-4-pyridinyl]oxy]-2,3-dimethylindole-1-carboxamide is sourced from PubChem (CID 69312789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).