5,6,14,15-tetramethylnonadecane

C23H48 — CID 123473711

IUPAC5,6,14,15-tetramethylnonadecane
SMILESCCCCC(C)C(C)CCCCCCCC(C)C(C)CCCC
InChIInChI=1S/C23H48/c1-7-9-16-20(3)22(5)18-14-12-11-13-15-19-23(6)21(4)17-10-8-2/h20-23H,7-19H2,1-6H3
InChIKeyYJCGHXULDNRJKC-UHFFFAOYSA-N
MW324.64 g/mol
LogP8.64
Rot. Bonds16

About 5,6,14,15-tetramethylnonadecane

5,6,14,15-tetramethylnonadecane (PubChem CID 123473711) has the molecular formula C23H48 and a molecular weight of 324.64 g/mol. Its IUPAC name is 5,6,14,15-tetramethylnonadecane.

Molecular Properties

Compound Name5,6,14,15-tetramethylnonadecane
PubChem CID123473711
Molecular FormulaC23H48
Molecular Weight324.64 g/mol
Exact Mass324.38
IUPAC Name5,6,14,15-tetramethylnonadecane
SMILESCCCCC(C)C(C)CCCCCCCC(C)C(C)CCCC
InChIInChI=1S/C23H48/c1-7-9-16-20(3)22(5)18-14-12-11-13-15-19-23(6)21(4)17-10-8-2/h20-23H,7-19H2,1-6H3
InChIKeyYJCGHXULDNRJKC-UHFFFAOYSA-N
XLogP8.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.64
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

11,12-dimethyltricosane
CID 173430605
16,17-dimethyltritriacontane
CID 91506561
(10S,11S)-10,11-dimethylicosane
CID 14870619
11,12-dimethyloctacosane
CID 23345853
8,9-dimethylhexacosane
CID 160651612
4,5-dimethylnonadecane
CID 123321090
2,3,14,15-tetramethylhenicosane
CID 123460288
9-butyl-10-methyloctadecane
CID 174796911
3,4-dimethyldecane;ethane
CID 170980289
11-butyl-12-methyldocosane
CID 151619606
2,3-dimethylnonacosane
CID 71331945
(5S,6R)-2,5,6-trimethyldecane
CID 154723790

Frequently Asked Questions

What is the IUPAC name of 5,6,14,15-tetramethylnonadecane?
The IUPAC name of 5,6,14,15-tetramethylnonadecane (CID 123473711) is 5,6,14,15-tetramethylnonadecane.
What is the SMILES notation for 5,6,14,15-tetramethylnonadecane?
The canonical SMILES for 5,6,14,15-tetramethylnonadecane is CCCCC(C)C(C)CCCCCCCC(C)C(C)CCCC.
What is the InChIKey of 5,6,14,15-tetramethylnonadecane?
The InChIKey is YJCGHXULDNRJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48/c1-7-9-16-20(3)22(5)18-14-12-11-13-15-19-23(6)21(4)17-10-8-2/h20-23H,7-19H2,1-6H3.
What are the key properties of 5,6,14,15-tetramethylnonadecane?
5,6,14,15-tetramethylnonadecane has a molecular weight of 324.64 g/mol, XLogP of 8.64, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,14,15-tetramethylnonadecane is sourced from PubChem (CID 123473711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).