2-propylpentylcyclobutane

C12H24 — CID 123848725

IUPAC2-propylpentylcyclobutane
SMILESCCCC(CCC)CC1CCC1
InChIInChI=1S/C12H24/c1-3-6-11(7-4-2)10-12-8-5-9-12/h11-12H,3-10H2,1-2H3
InChIKeyRAHOBSGCEYPLAE-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.39
Rot. Bonds6

About 2-propylpentylcyclobutane

2-propylpentylcyclobutane (PubChem CID 123848725) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 2-propylpentylcyclobutane.

Molecular Properties

Compound Name2-propylpentylcyclobutane
PubChem CID123848725
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name2-propylpentylcyclobutane
SMILESCCCC(CCC)CC1CCC1
InChIInChI=1S/C12H24/c1-3-6-11(7-4-2)10-12-8-5-9-12/h11-12H,3-10H2,1-2H3
InChIKeyRAHOBSGCEYPLAE-UHFFFAOYSA-N
XLogP4.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(cyclopropylmethyl)pentylcyclobutane
CID 57282892
2-(cyclopentylmethyl)pentan-1-amine
CID 62503490
2-propan-2-ylpentylcyclobutane
CID 161147859
ethane;ethylcyclobutane;3-ethylhexane
CID 143637843
(10-methyl-2,4-dipropylhexadecyl)cyclobutane
CID 123528553
2-(cyclohexylmethyl)-N-(2-methylpropyl)pentan-1-amine
CID 55196028
1-cyclobutyl-3-methylhexan-2-ol
CID 115802415
2-prop-1-en-2-ylpentylcyclobutane
CID 123471153
2-(cyclopentylmethyl)-N-(2-methoxyethyl)pentan-1-amine
CID 62718489
3-ethylhexylcyclopentane
CID 123372890
1-(7-ethyl-15-methyl-2-propylheptadecyl)-3-methylcyclohexane
CID 178080856
1,3-bis(2-methylpentyl)cyclohexane;methane
CID 173426658

Frequently Asked Questions

What is the IUPAC name of 2-propylpentylcyclobutane?
The IUPAC name of 2-propylpentylcyclobutane (CID 123848725) is 2-propylpentylcyclobutane.
What is the SMILES notation for 2-propylpentylcyclobutane?
The canonical SMILES for 2-propylpentylcyclobutane is CCCC(CCC)CC1CCC1.
What is the InChIKey of 2-propylpentylcyclobutane?
The InChIKey is RAHOBSGCEYPLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-3-6-11(7-4-2)10-12-8-5-9-12/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-propylpentylcyclobutane?
2-propylpentylcyclobutane has a molecular weight of 168.32 g/mol, XLogP of 4.39, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propylpentylcyclobutane is sourced from PubChem (CID 123848725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).