1-methyl-1-propan-2-yl-3-propylcyclobutane

C11H22 — CID 91462890

IUPAC1-methyl-1-propan-2-yl-3-propylcyclobutane
SMILESCCCC1CC(C)(C(C)C)C1
InChIInChI=1S/C11H22/c1-5-6-10-7-11(4,8-10)9(2)3/h9-10H,5-8H2,1-4H3
InChIKeyLHVKZGIECDORJZ-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.86
Rot. Bonds3

About 1-methyl-1-propan-2-yl-3-propylcyclobutane

1-methyl-1-propan-2-yl-3-propylcyclobutane (PubChem CID 91462890) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 1-methyl-1-propan-2-yl-3-propylcyclobutane.

Molecular Properties

Compound Name1-methyl-1-propan-2-yl-3-propylcyclobutane
PubChem CID91462890
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name1-methyl-1-propan-2-yl-3-propylcyclobutane
SMILESCCCC1CC(C)(C(C)C)C1
InChIInChI=1S/C11H22/c1-5-6-10-7-11(4,8-10)9(2)3/h9-10H,5-8H2,1-4H3
InChIKeyLHVKZGIECDORJZ-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1-dimethyl-3-propylcyclobutane
CID 19073360
3-propylcyclobutane-1,1-diol
CID 18328679
cis-(1S,2R)-1,2-diethyl-1,2-dimethyl-4-propylcyclopentane
CID 143682389
3-ethyl-1-methyl-1-propan-2-ylcyclopentane
CID 91433980
3-ethyl-1-methyl-1-pentan-2-ylcyclobutane
CID 123384644
1-propan-2-yl-4-propylcycloheptan-1-amine
CID 65086543
1,7-dimethyl-7-propan-2-yl-5-propylbicyclo[6.2.0]decane
CID 123925598
1,1-bis(methoxymethyl)-3-propylcyclobutane
CID 141062334
(1-phosphono-3-propylcyclobutyl)phosphonic acid
CID 19821558
1-(3-butyl-1-methylcyclohexyl)ethanamine
CID 167255751
1-methyl-1-(3-methyl-2-pentylcyclobutyl)-3-propylcyclobutane
CID 123649878
ethane;1-ethyl-4-propylcyclohexane;2-methylpropane
CID 166536374

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-propan-2-yl-3-propylcyclobutane?
The IUPAC name of 1-methyl-1-propan-2-yl-3-propylcyclobutane (CID 91462890) is 1-methyl-1-propan-2-yl-3-propylcyclobutane.
What is the SMILES notation for 1-methyl-1-propan-2-yl-3-propylcyclobutane?
The canonical SMILES for 1-methyl-1-propan-2-yl-3-propylcyclobutane is CCCC1CC(C)(C(C)C)C1.
What is the InChIKey of 1-methyl-1-propan-2-yl-3-propylcyclobutane?
The InChIKey is LHVKZGIECDORJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-5-6-10-7-11(4,8-10)9(2)3/h9-10H,5-8H2,1-4H3.
What are the key properties of 1-methyl-1-propan-2-yl-3-propylcyclobutane?
1-methyl-1-propan-2-yl-3-propylcyclobutane has a molecular weight of 154.30 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-propan-2-yl-3-propylcyclobutane is sourced from PubChem (CID 91462890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).