ethane;methane;1,3-xylene

C15H34 — CID 145463381

IUPACethane;methane;1,3-xylene
SMILESC.C.C.CC.CC.Cc1cccc(C)c1
InChIInChI=1S/C8H10.2C2H6.3CH4/c1-7-4-3-5-8(2)6-7;2*1-2;;;/h3-6H,1-2H3;2*1-2H3;3*1H4
InChIKeyAOCBDXJLAGOBTN-UHFFFAOYSA-N
MW214.44 g/mol
LogP6.26
Rot. Bonds

About ethane;methane;1,3-xylene

ethane;methane;1,3-xylene (PubChem CID 145463381) has the molecular formula C15H34 and a molecular weight of 214.44 g/mol. Its IUPAC name is ethane;methane;1,3-xylene.

Molecular Properties

Compound Nameethane;methane;1,3-xylene
PubChem CID145463381
Molecular FormulaC15H34
Molecular Weight214.44 g/mol
Exact Mass214.27
IUPAC Nameethane;methane;1,3-xylene
SMILESC.C.C.CC.CC.Cc1cccc(C)c1
InChIInChI=1S/C8H10.2C2H6.3CH4/c1-7-4-3-5-8(2)6-7;2*1-2;;;/h3-6H,1-2H3;2*1-2H3;3*1H4
InChIKeyAOCBDXJLAGOBTN-UHFFFAOYSA-N
XLogP6.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500214.44
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze ethane;methane;1,3-xylene with MolForge

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

Launch Full Analysis

Related Compounds

ethane;1,3-xylene
CID 54570178
ethane;1,3-xylene;1,4-xylene
CID 145425556
ethane;methanol;1,3-xylene
CID 156743127
methane;1,3-xylene;1,4-xylene
CID 161051420
phosphane;tris(1,3-xylene)
CID 67351774
argon;1,3-xylene
CID 161468194
uranium;1,3-xylene
CID 142096795
ethane;propane;1,3-xylene
CID 144528046
azane;1,3-xylene;hydrochloride
CID 175000695
carbon dioxide;1,3-xylene
CID 160806691
dioxoosmium;1,3-xylene
CID 57347095
ethane;methylcyclopropane;1,3-xylene
CID 142338532

Frequently Asked Questions

What is the IUPAC name of ethane;methane;1,3-xylene?
The IUPAC name of ethane;methane;1,3-xylene (CID 145463381) is ethane;methane;1,3-xylene.
What is the SMILES notation for ethane;methane;1,3-xylene?
The canonical SMILES for ethane;methane;1,3-xylene is C.C.C.CC.CC.Cc1cccc(C)c1.
What is the InChIKey of ethane;methane;1,3-xylene?
The InChIKey is AOCBDXJLAGOBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.2C2H6.3CH4/c1-7-4-3-5-8(2)6-7;2*1-2;;;/h3-6H,1-2H3;2*1-2H3;3*1H4.
What are the key properties of ethane;methane;1,3-xylene?
ethane;methane;1,3-xylene has a molecular weight of 214.44 g/mol, XLogP of 6.26, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;1,3-xylene is sourced from PubChem (CID 145463381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).