ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen

C14H24N2 — CID 160810473

IUPACethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen
SMILESCC.CCc1ccnc2c1c(C)c(C)n2C.[H][H]
InChIInChI=1S/C12H16N2.C2H6.H2/c1-5-10-6-7-13-12-11(10)8(2)9(3)14(12)4;1-2;/h6-7H,5H2,1-4H3;1-2H3;1H
InChIKeySEGFUAGMCANDBM-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.02
Rot. Bonds1

About ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen

ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen (PubChem CID 160810473) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen.

Molecular Properties

Compound Nameethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen
PubChem CID160810473
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Nameethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen
SMILESCC.CCc1ccnc2c1c(C)c(C)n2C.[H][H]
InChIInChI=1S/C12H16N2.C2H6.H2/c1-5-10-6-7-13-12-11(10)8(2)9(3)14(12)4;1-2;/h6-7H,5H2,1-4H3;1-2H3;1H
InChIKeySEGFUAGMCANDBM-UHFFFAOYSA-N
XLogP4.02
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen 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 ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen?
The IUPAC name of ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen (CID 160810473) is ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen.
What is the SMILES notation for ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen?
The canonical SMILES for ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen is CC.CCc1ccnc2c1c(C)c(C)n2C.[H][H].
What is the InChIKey of ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen?
The InChIKey is SEGFUAGMCANDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2.C2H6.H2/c1-5-10-6-7-13-12-11(10)8(2)9(3)14(12)4;1-2;/h6-7H,5H2,1-4H3;1-2H3;1H.
What are the key properties of ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen?
ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen has a molecular weight of 220.36 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-1,2,3-trimethylpyrrolo[2,3-b]pyridine;molecular hydrogen is sourced from PubChem (CID 160810473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).