2-methyl-4,4,5,5,6-pentapropylnonane

C25H52 — CID 173297835

IUPAC2-methyl-4,4,5,5,6-pentapropylnonane
SMILESCCCC(CCC)C(CCC)(CCC)C(CCC)(CCC)CC(C)C
InChIInChI=1S/C25H52/c1-9-15-23(16-10-2)25(19-13-5,20-14-6)24(17-11-3,18-12-4)21-22(7)8/h22-23H,9-21H2,1-8H3
InChIKeyGJPCFEQXXOEAMC-UHFFFAOYSA-N
MW352.69 g/mol
LogP9.42
Rot. Bonds16

About 2-methyl-4,4,5,5,6-pentapropylnonane

2-methyl-4,4,5,5,6-pentapropylnonane (PubChem CID 173297835) has the molecular formula C25H52 and a molecular weight of 352.69 g/mol. Its IUPAC name is 2-methyl-4,4,5,5,6-pentapropylnonane.

Molecular Properties

Compound Name2-methyl-4,4,5,5,6-pentapropylnonane
PubChem CID173297835
Molecular FormulaC25H52
Molecular Weight352.69 g/mol
Exact Mass352.41
IUPAC Name2-methyl-4,4,5,5,6-pentapropylnonane
SMILESCCCC(CCC)C(CCC)(CCC)C(CCC)(CCC)CC(C)C
InChIInChI=1S/C25H52/c1-9-15-23(16-10-2)25(19-13-5,20-14-6)24(17-11-3,18-12-4)21-22(7)8/h22-23H,9-21H2,1-8H3
InChIKeyGJPCFEQXXOEAMC-UHFFFAOYSA-N
XLogP9.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.69
LogP ≤ 59.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-dimethyl-4-propyloctane
CID 57491235
5-(2-methylpropyl)nonan-5-amine
CID 88761377
2,4-dimethylheptan-4-olate
CID 58624964
(4S)-2,4-dimethyl-4-propan-2-ylheptane
CID 58432708
2-methylpentane
CID 7892
4-tert-butyl-6,6-dimethyldecane
CID 173185098
4-amino-5-propyloctan-4-ol
CID 18625026
4-bromo-2-methyl-4-(2-methylpropyl)octane
CID 175058351
(7S)-5,7-dimethyl-5-propylundecane
CID 175363506
(4R,6S)-2,2,4,6-tetramethyl-4-propylnonane
CID 58193630
6-butan-2-yl-4,5-diethyl-5-fluoro-6-(2-methylpropyl)-4-propan-2-yldecane
CID 141008707
3,5-dimethyl-3-propylhexan-2-ol
CID 20501854

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,4,5,5,6-pentapropylnonane?
The IUPAC name of 2-methyl-4,4,5,5,6-pentapropylnonane (CID 173297835) is 2-methyl-4,4,5,5,6-pentapropylnonane.
What is the SMILES notation for 2-methyl-4,4,5,5,6-pentapropylnonane?
The canonical SMILES for 2-methyl-4,4,5,5,6-pentapropylnonane is CCCC(CCC)C(CCC)(CCC)C(CCC)(CCC)CC(C)C.
What is the InChIKey of 2-methyl-4,4,5,5,6-pentapropylnonane?
The InChIKey is GJPCFEQXXOEAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H52/c1-9-15-23(16-10-2)25(19-13-5,20-14-6)24(17-11-3,18-12-4)21-22(7)8/h22-23H,9-21H2,1-8H3.
What are the key properties of 2-methyl-4,4,5,5,6-pentapropylnonane?
2-methyl-4,4,5,5,6-pentapropylnonane has a molecular weight of 352.69 g/mol, XLogP of 9.42, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,4,5,5,6-pentapropylnonane is sourced from PubChem (CID 173297835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).