1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane

C15H30 — CID 123939374

IUPAC1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane
SMILESCCC(C)CC(CC)C1CC(C)CC1C
InChIInChI=1S/C15H30/c1-6-11(3)9-14(7-2)15-10-12(4)8-13(15)5/h11-15H,6-10H2,1-5H3
InChIKeyCKSHGUFLIIPQNK-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.13
Rot. Bonds5

About 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane

1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane (PubChem CID 123939374) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane.

Molecular Properties

Compound Name1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane
PubChem CID123939374
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane
SMILESCCC(C)CC(CC)C1CC(C)CC1C
InChIInChI=1S/C15H30/c1-6-11(3)9-14(7-2)15-10-12(4)8-13(15)5/h11-15H,6-10H2,1-5H3
InChIKeyCKSHGUFLIIPQNK-UHFFFAOYSA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-2-(5-methyloctan-3-yl)cyclopropane
CID 123251321
1,4-dimethyl-2-(2-methylpentan-3-yl)cyclopentane
CID 91069892
2-(5-methylheptan-3-yl)bicyclo[1.1.0]butane
CID 123495492
1,4-dimethyl-2-propan-2-ylcyclopentane
CID 91513076
2-butan-2-yl-1,3,5-trimethylcyclohexane
CID 90972647
3-methyl-1-(2-methylcyclopropyl)pentan-1-amine
CID 65419955
1-(4,6-dimethyloctan-2-yl)-3-methylcyclobutane
CID 123289124
1,2-dimethyl-3-(4-methylhexan-2-yl)cyclobutane
CID 123367002
1-(2,5-dimethylheptan-3-yl)-2,3-dimethylcyclobutane
CID 123429129
1-(4,7-dimethylnonan-2-yl)-3-methylcyclobutane
CID 123489822
1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane
CID 123749319
1-methyl-2-(4-methylhexan-2-yl)cyclopentane
CID 123800434

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane?
The IUPAC name of 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane (CID 123939374) is 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane.
What is the SMILES notation for 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane?
The canonical SMILES for 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane is CCC(C)CC(CC)C1CC(C)CC1C.
What is the InChIKey of 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane?
The InChIKey is CKSHGUFLIIPQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-6-11(3)9-14(7-2)15-10-12(4)8-13(15)5/h11-15H,6-10H2,1-5H3.
What are the key properties of 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane?
1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane has a molecular weight of 210.40 g/mol, XLogP of 5.13, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-(5-methylheptan-3-yl)cyclopentane is sourced from PubChem (CID 123939374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).