(5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane

C15H30 — CID 144902537

IUPAC(5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane
SMILESCC1CC(CCC(C)C(C)C)C[C@H](C)C1
InChIInChI=1S/C15H30/c1-11(2)14(5)6-7-15-9-12(3)8-13(4)10-15/h11-15H,6-10H2,1-5H3/t12-,13?,14?,15?/m1/s1
InChIKeyCYLCEXUBWKFIID-AUXXQLBISA-N
MW210.41 g/mol
LogP5.13
Rot. Bonds4

About (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane

(5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane (PubChem CID 144902537) has the molecular formula C15H30 and a molecular weight of 210.41 g/mol. Its IUPAC name is (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane.

Molecular Properties

Compound Name(5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane
PubChem CID144902537
Molecular FormulaC15H30
Molecular Weight210.41 g/mol
Exact Mass210.23
IUPAC Name(5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane
SMILESCC1CC(CCC(C)C(C)C)C[C@H](C)C1
InChIInChI=1S/C15H30/c1-11(2)14(5)6-7-15-9-12(3)8-13(4)10-15/h11-15H,6-10H2,1-5H3/t12-,13?,14?,15?/m1/s1
InChIKeyCYLCEXUBWKFIID-AUXXQLBISA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.41
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-3-(3-methylhexyl)cyclobutane
CID 90803912
1-(3-bromo-3-cyclopropylpropyl)-3,5-dimethylcyclohexane
CID 64728555
1-(3,5-dimethylcyclohexyl)hexan-3-ol
CID 64730162
1,3-dimethyl-5-propylcyclohexane
CID 13144142
1-(3,5-dimethylcyclohexyl)propan-2-amine
CID 70312991
1,3-dimethyl-5-propylcyclohexane;ethane
CID 142054568
1-(3,4-dimethylpentyl)-2-ethylcyclopropane
CID 123908789
(1S)-1-methyl-3-(3-methylbutyl)cyclopentane
CID 148998562
cis-(3R,5S)-1-[(3R)-2,4-dimethyl-3-propan-2-ylhexyl]-3,5-dimethylcyclohexane
CID 142072812
2-(3-methylcyclobutyl)ethanol
CID 59157244
ethane;2-methylbutane;1-methyl-3-(3-methylpentyl)cyclobutane;propan-2-ylcyclobutane
CID 143682617
3-methyl-5-(3-methylbutyl)piperidine
CID 106778430

Frequently Asked Questions

What is the IUPAC name of (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane?
The IUPAC name of (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane (CID 144902537) is (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane.
What is the SMILES notation for (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane?
The canonical SMILES for (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane is CC1CC(CCC(C)C(C)C)C[C@H](C)C1.
What is the InChIKey of (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane?
The InChIKey is CYLCEXUBWKFIID-AUXXQLBISA-N. The full InChI is InChI=1S/C15H30/c1-11(2)14(5)6-7-15-9-12(3)8-13(4)10-15/h11-15H,6-10H2,1-5H3/t12-,13?,14?,15?/m1/s1.
What are the key properties of (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane?
(5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane has a molecular weight of 210.41 g/mol, XLogP of 5.13, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-(3,4-dimethylpentyl)-3,5-dimethylcyclohexane is sourced from PubChem (CID 144902537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).