3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane

C95H190 — CID 159602512

IUPAC3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
SMILESCC(C)CC1CC1.CC(C)CC1CCC1.CC(C)CC1CCCC1.CC(C)CC1CCCCC1.CC(C)CC1CCCCCC1.CC(C)CCC1CC1.CC(C)CCC1CCC1.CC(C)CCC1CCCC1.CC(C)CCC1CCCCC1.CC(C)CCC1CCCCCC1
InChIInChI=1S/C12H24.2C11H22.2C10H20.2C9H18.2C8H16.C7H14/c1-11(2)9-10-12-7-5-3-4-6-8-12;1-10(2)8-9-11-6-4-3-5-7-11;1-10(2)9-11-7-5-3-4-6-8-11;1-9(2)7-8-10-5-3-4-6-10;1-9(2)8-10-6-4-3-5-7-10;1-8(2)6-7-9-4-3-5-9;1-8(2)7-9-5-3-4-6-9;1-7(2)3-4-8-5-6-8;1-7(2)6-8-4-3-5-8;1-6(2)5-7-3-4-7/h11-12H,3-10H2,1-2H3;2*10-11H,3-9H2,1-2H3;2*9-10H,3-8H2,1-2H3;2*8-9H,3-7H2,1-2H3;2*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3
InChIKeyMLQYEVZNJHKJFP-UHFFFAOYSA-N
MW1332.56 g/mol
LogP34.18
Rot. Bonds25

About 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane

3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane (PubChem CID 159602512) has the molecular formula C95H190 and a molecular weight of 1332.56 g/mol. Its IUPAC name is 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane.

Molecular Properties

Compound Name3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
PubChem CID159602512
Molecular FormulaC95H190
Molecular Weight1332.56 g/mol
Exact Mass1331.49
IUPAC Name3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
SMILESCC(C)CC1CC1.CC(C)CC1CCC1.CC(C)CC1CCCC1.CC(C)CC1CCCCC1.CC(C)CC1CCCCCC1.CC(C)CCC1CC1.CC(C)CCC1CCC1.CC(C)CCC1CCCC1.CC(C)CCC1CCCCC1.CC(C)CCC1CCCCCC1
InChIInChI=1S/C12H24.2C11H22.2C10H20.2C9H18.2C8H16.C7H14/c1-11(2)9-10-12-7-5-3-4-6-8-12;1-10(2)8-9-11-6-4-3-5-7-11;1-10(2)9-11-7-5-3-4-6-8-11;1-9(2)7-8-10-5-3-4-6-10;1-9(2)8-10-6-4-3-5-7-10;1-8(2)6-7-9-4-3-5-9;1-8(2)7-9-5-3-4-6-9;1-7(2)3-4-8-5-6-8;1-7(2)6-8-4-3-5-8;1-6(2)5-7-3-4-7/h11-12H,3-10H2,1-2H3;2*10-11H,3-9H2,1-2H3;2*9-10H,3-8H2,1-2H3;2*8-9H,3-7H2,1-2H3;2*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3
InChIKeyMLQYEVZNJHKJFP-UHFFFAOYSA-N
XLogP34.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds25
Heavy Atoms95
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001332.56
LogP ≤ 534.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane with MolForge

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Related Compounds

2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159692112
bis(2-methylpropylcyclohexane);2-methylpropylcyclopentane
CID 159474199
2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159402972
cyclopentane;iron;2-methylpropylcyclopentane
CID 172726896
1-ethyl-4-(3-methylbutyl)cycloheptane
CID 123171853
methane;2-methylpropylcyclopentane
CID 161254337
3-methylbutan-2-ylcyclohexane;bis(2-methylpropylcyclobutane);2-methylpropylcyclohexane
CID 161332116
ethane;3-methylbutylcyclohexane;2-methylpropylcyclohexane;propylbenzene
CID 167540027
1-cycloheptyl-5-methylhexan-2-ol
CID 115783773
4-methylpentylcyclopentane
CID 523530
(1-cyclohexyl-2-methylpropyl)cyclohexane;ethane;2-methylpropylcyclohexane
CID 157285148
1-[5-(3-methylbutyl)cyclononyl]prop-2-en-1-one
CID 91599650

Frequently Asked Questions

What is the IUPAC name of 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane?
The IUPAC name of 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane (CID 159602512) is 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane.
What is the SMILES notation for 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane?
The canonical SMILES for 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane is CC(C)CC1CC1.CC(C)CC1CCC1.CC(C)CC1CCCC1.CC(C)CC1CCCCC1.CC(C)CC1CCCCCC1.CC(C)CCC1CC1.CC(C)CCC1CCC1.CC(C)CCC1CCCC1.CC(C)CCC1CCCCC1.CC(C)CCC1CCCCCC1.
What is the InChIKey of 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane?
The InChIKey is MLQYEVZNJHKJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24.2C11H22.2C10H20.2C9H18.2C8H16.C7H14/c1-11(2)9-10-12-7-5-3-4-6-8-12;1-10(2)8-9-11-6-4-3-5-7-11;1-10(2)9-11-7-5-3-4-6-8-11;1-9(2)7-8-10-5-3-4-6-10;1-9(2)8-10-6-4-3-5-7-10;1-8(2)6-7-9-4-3-5-9;1-8(2)7-9-5-3-4-6-9;1-7(2)3-4-8-5-6-8;1-7(2)6-8-4-3-5-8;1-6(2)5-7-3-4-7/h11-12H,3-10H2,1-2H3;2*10-11H,3-9H2,1-2H3;2*9-10H,3-8H2,1-2H3;2*8-9H,3-7H2,1-2H3;2*7-8H,3-6H2,1-2H3;6-7H,3-5H2,1-2H3.
What are the key properties of 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane?
3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane has a molecular weight of 1332.56 g/mol, XLogP of 34.18, 25 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylbutylcyclobutane;3-methylbutylcycloheptane;3-methylbutylcyclohexane;3-methylbutylcyclopentane;3-methylbutylcyclopropane;2-methylpropylcyclobutane;2-methylpropylcycloheptane;2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane is sourced from PubChem (CID 159602512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).