2-butyl-4-ethyl-1-propylcyclohexane

C15H30 — CID 123402768

IUPAC2-butyl-4-ethyl-1-propylcyclohexane
SMILESCCCCC1CC(CC)CCC1CCC
InChIInChI=1S/C15H30/c1-4-7-9-15-12-13(6-3)10-11-14(15)8-5-2/h13-15H,4-12H2,1-3H3
InChIKeyRBNILHCDBVUCIZ-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.42
Rot. Bonds6

About 2-butyl-4-ethyl-1-propylcyclohexane

2-butyl-4-ethyl-1-propylcyclohexane (PubChem CID 123402768) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 2-butyl-4-ethyl-1-propylcyclohexane.

Molecular Properties

Compound Name2-butyl-4-ethyl-1-propylcyclohexane
PubChem CID123402768
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name2-butyl-4-ethyl-1-propylcyclohexane
SMILESCCCCC1CC(CC)CCC1CCC
InChIInChI=1S/C15H30/c1-4-7-9-15-12-13(6-3)10-11-14(15)8-5-2/h13-15H,4-12H2,1-3H3
InChIKeyRBNILHCDBVUCIZ-UHFFFAOYSA-N
XLogP5.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(4-ethyl-2-octylcyclohexyl)methanamine
CID 81012449
N-[(2-butyl-4-ethylcyclohexyl)methyl]-2-methylpropan-1-amine
CID 81029219
2-butyl-N,4-diethylcyclohexan-1-amine
CID 63403670
trans-(1R,2R)-1-butyl-2-propylcyclopentane
CID 14574886
1-bromo-4-ethyl-2-pentylcyclohexane
CID 63472989
2-dodecyl-4-ethylcyclohexan-1-ol
CID 63461251
3,4-dibutylcyclohexan-1-ol
CID 71347162
cis-(1R,2S)-1-butyl-2-ethylcyclopropane
CID 6427612
1-propyl-2-undecylcyclopropane
CID 123636027
1-butyl-4-ethylcyclohexane;methane
CID 145295190
1-(2-hexyl-4-propylcyclohexyl)-N-methylmethanamine
CID 81029078
2-decyl-N,4-diethylcyclohexan-1-amine
CID 63403278

Frequently Asked Questions

What is the IUPAC name of 2-butyl-4-ethyl-1-propylcyclohexane?
The IUPAC name of 2-butyl-4-ethyl-1-propylcyclohexane (CID 123402768) is 2-butyl-4-ethyl-1-propylcyclohexane.
What is the SMILES notation for 2-butyl-4-ethyl-1-propylcyclohexane?
The canonical SMILES for 2-butyl-4-ethyl-1-propylcyclohexane is CCCCC1CC(CC)CCC1CCC.
What is the InChIKey of 2-butyl-4-ethyl-1-propylcyclohexane?
The InChIKey is RBNILHCDBVUCIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-4-7-9-15-12-13(6-3)10-11-14(15)8-5-2/h13-15H,4-12H2,1-3H3.
What are the key properties of 2-butyl-4-ethyl-1-propylcyclohexane?
2-butyl-4-ethyl-1-propylcyclohexane has a molecular weight of 210.40 g/mol, XLogP of 5.42, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-4-ethyl-1-propylcyclohexane is sourced from PubChem (CID 123402768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).