2-methylnonane

C10H22 — CID 13379

IUPAC2-methylnonane
SMILESCCCCCCCC(C)C
InChIInChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3
InChIKeySGVYKUFIHHTIFL-UHFFFAOYSA-N
MW142.29 g/mol
LogP4.00
Rot. Bonds6

About 2-methylnonane

2-methylnonane (PubChem CID 13379) has the molecular formula C10H22 and a molecular weight of 142.29 g/mol. Its IUPAC name is 2-methylnonane.

Molecular Properties

Compound Name2-methylnonane
PubChem CID13379
Molecular FormulaC10H22
Molecular Weight142.29 g/mol
Exact Mass142.17
IUPAC Name2-methylnonane
SMILESCCCCCCCC(C)C
InChIInChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3
InChIKeySGVYKUFIHHTIFL-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.29
LogP ≤ 54.00
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

Pristane
CID 15979
2-Methylheptane
CID 11594
2-Methyldecane
CID 23415
Squalane
CID 8089
Phytane
CID 12523
2-Methyloctane
CID 18591
4-Methylheptane
CID 11512
3-Methylheptane
CID 11519
Pentylcyclohexane
CID 20284
2-Methylundecane
CID 23459
Farnesane
CID 19773
2,5-Dimethylhexane
CID 11592

Frequently Asked Questions

What is the IUPAC name of 2-methylnonane?
The IUPAC name of 2-methylnonane (CID 13379) is 2-methylnonane.
What is the SMILES notation for 2-methylnonane?
The canonical SMILES for 2-methylnonane is CCCCCCCC(C)C.
What is the InChIKey of 2-methylnonane?
The InChIKey is SGVYKUFIHHTIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3.
What are the key properties of 2-methylnonane?
2-methylnonane has a molecular weight of 142.29 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylnonane is sourced from PubChem (CID 13379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).