[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane

C14H26 — CID 57296236

IUPAC[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane
SMILESCCC(C)C(CC1CCC1)CC1CC1
InChIInChI=1S/C14H26/c1-3-11(2)14(10-13-7-8-13)9-12-5-4-6-12/h11-14H,3-10H2,1-2H3
InChIKeyKBYSJLJXGBAXGM-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.64
Rot. Bonds6

About [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane

[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane (PubChem CID 57296236) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane.

Molecular Properties

Compound Name[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane
PubChem CID57296236
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane
SMILESCCC(C)C(CC1CCC1)CC1CC1
InChIInChI=1S/C14H26/c1-3-11(2)14(10-13-7-8-13)9-12-5-4-6-12/h11-14H,3-10H2,1-2H3
InChIKeyKBYSJLJXGBAXGM-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2-ethyl-3-methylpentyl)cyclohexane
CID 91213059
2-butan-2-ylhexylcyclopropane
CID 123731337
1-cyclobutyl-3-methylpentan-2-ol
CID 65459256
(2-chloro-3-methylpentyl)cyclopropane
CID 130480709
2-propan-2-ylpentylcyclobutane
CID 161147859
1-cyclopropyl-3-methylpentan-2-amine
CID 64904257
N-(cyclobutylmethyl)-1-cyclopropylbutan-2-amine
CID 65459186
(1-cyclopentyl-3-methylpentan-2-yl)hydrazine
CID 105219565
2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159402972
2,3-dimethylpentane;methane;2-methylpropylcyclobutane;2-methylpropylcyclopropane;propan-2-ylcyclohexane;2,2,3-trimethylbutane
CID 160935897
1-cyclopentyl-4-ethylhexane-2,5-diol
CID 103160935
[(3R)-3-methylpentan-2-yl]cyclopentane
CID 144516432

Frequently Asked Questions

What is the IUPAC name of [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane?
The IUPAC name of [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane (CID 57296236) is [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane.
What is the SMILES notation for [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane?
The canonical SMILES for [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane is CCC(C)C(CC1CCC1)CC1CC1.
What is the InChIKey of [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane?
The InChIKey is KBYSJLJXGBAXGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-3-11(2)14(10-13-7-8-13)9-12-5-4-6-12/h11-14H,3-10H2,1-2H3.
What are the key properties of [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane?
[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane has a molecular weight of 194.36 g/mol, XLogP of 4.64, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane is sourced from PubChem (CID 57296236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).