1-(2-methylbutyl)-2-propylcyclobutane

C12H24 — CID 90731668

IUPAC1-(2-methylbutyl)-2-propylcyclobutane
SMILESCCCC1CCC1CC(C)CC
InChIInChI=1S/C12H24/c1-4-6-11-7-8-12(11)9-10(3)5-2/h10-12H,4-9H2,1-3H3
InChIKeyNHLRPYPKXVOEHO-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.25
Rot. Bonds5

About 1-(2-methylbutyl)-2-propylcyclobutane

1-(2-methylbutyl)-2-propylcyclobutane (PubChem CID 90731668) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 1-(2-methylbutyl)-2-propylcyclobutane.

Molecular Properties

Compound Name1-(2-methylbutyl)-2-propylcyclobutane
PubChem CID90731668
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name1-(2-methylbutyl)-2-propylcyclobutane
SMILESCCCC1CCC1CC(C)CC
InChIInChI=1S/C12H24/c1-4-6-11-7-8-12(11)9-10(3)5-2/h10-12H,4-9H2,1-3H3
InChIKeyNHLRPYPKXVOEHO-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(2-methylbutyl)-2-propylcyclopropane
CID 90912055
1-ethyl-2-(2-methylbutyl)cyclopentane
CID 144979095
2-(2-methylbutyl)-4-propylcyclohexan-1-ol
CID 63459236
1-methyl-2-(2-methylbutyl)cyclopropane
CID 91076617
N-methyl-1-[2-(2-methylbutyl)cyclohexyl]methanamine
CID 81027427
cis-(1S,2R)-1,2-dipropylcyclohexane
CID 143217114
1-chloro-4-methyl-2-(2-methylbutyl)cyclohexane
CID 63460977
N-[[2-(2-methylbutyl)cyclohexyl]methyl]ethanamine
CID 81028834
[2-(2,4-dimethylpentyl)-4-propylcyclohexyl]methanamine
CID 114201490
2-methyl-1,3-dipropylcyclopentane
CID 90887551
[4-(2-methylbutyl)cyclohexyl]methanamine
CID 130208059
N,4-dimethyl-2-(2-methylbutyl)cyclohexan-1-amine
CID 62104395

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylbutyl)-2-propylcyclobutane?
The IUPAC name of 1-(2-methylbutyl)-2-propylcyclobutane (CID 90731668) is 1-(2-methylbutyl)-2-propylcyclobutane.
What is the SMILES notation for 1-(2-methylbutyl)-2-propylcyclobutane?
The canonical SMILES for 1-(2-methylbutyl)-2-propylcyclobutane is CCCC1CCC1CC(C)CC.
What is the InChIKey of 1-(2-methylbutyl)-2-propylcyclobutane?
The InChIKey is NHLRPYPKXVOEHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-4-6-11-7-8-12(11)9-10(3)5-2/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-(2-methylbutyl)-2-propylcyclobutane?
1-(2-methylbutyl)-2-propylcyclobutane has a molecular weight of 168.32 g/mol, XLogP of 4.25, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylbutyl)-2-propylcyclobutane is sourced from PubChem (CID 90731668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).