ethane;methane;2-methylquinoline

C13H19N — CID 144748871

IUPACethane;methane;2-methylquinoline
SMILESC.CC.Cc1ccc2ccccc2n1
InChIInChI=1S/C10H9N.C2H6.CH4/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-2;/h2-7H,1H3;1-2H3;1H4
InChIKeyRZNDYWXMCVZNNN-UHFFFAOYSA-N
MW189.30 g/mol
LogP4.21
Rot. Bonds

About ethane;methane;2-methylquinoline

ethane;methane;2-methylquinoline (PubChem CID 144748871) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is ethane;methane;2-methylquinoline.

Molecular Properties

Compound Nameethane;methane;2-methylquinoline
PubChem CID144748871
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Nameethane;methane;2-methylquinoline
SMILESC.CC.Cc1ccc2ccccc2n1
InChIInChI=1S/C10H9N.C2H6.CH4/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-2;/h2-7H,1H3;1-2H3;1H4
InChIKeyRZNDYWXMCVZNNN-UHFFFAOYSA-N
XLogP4.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;methane;2-methylquinoline?
The IUPAC name of ethane;methane;2-methylquinoline (CID 144748871) is ethane;methane;2-methylquinoline.
What is the SMILES notation for ethane;methane;2-methylquinoline?
The canonical SMILES for ethane;methane;2-methylquinoline is C.CC.Cc1ccc2ccccc2n1.
What is the InChIKey of ethane;methane;2-methylquinoline?
The InChIKey is RZNDYWXMCVZNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N.C2H6.CH4/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-2;/h2-7H,1H3;1-2H3;1H4.
What are the key properties of ethane;methane;2-methylquinoline?
ethane;methane;2-methylquinoline has a molecular weight of 189.30 g/mol, XLogP of 4.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;2-methylquinoline is sourced from PubChem (CID 144748871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).