trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane

C10H18 — CID 91694383

IUPACtrans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane
SMILESCC(C)=C1[C@H](C(C)C)[C@H]1C
InChIInChI=1S/C10H18/c1-6(2)9-8(5)10(9)7(3)4/h6,8-9H,1-5H3/t8-,9-/m1/s1
InChIKeyYMHRHZGFRVCIFH-RKDXNWHRSA-N
MW138.25 g/mol
LogP3.24
Rot. Bonds1

About trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane

trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane (PubChem CID 91694383) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane.

Molecular Properties

Compound Nametrans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane
PubChem CID91694383
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Nametrans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane
SMILESCC(C)=C1[C@H](C(C)C)[C@H]1C
InChIInChI=1S/C10H18/c1-6(2)9-8(5)10(9)7(3)4/h6,8-9H,1-5H3/t8-,9-/m1/s1
InChIKeyYMHRHZGFRVCIFH-RKDXNWHRSA-N
XLogP3.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane?
The IUPAC name of trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane (CID 91694383) is trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane.
What is the SMILES notation for trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane?
The canonical SMILES for trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane is CC(C)=C1[C@H](C(C)C)[C@H]1C.
What is the InChIKey of trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane?
The InChIKey is YMHRHZGFRVCIFH-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H18/c1-6(2)9-8(5)10(9)7(3)4/h6,8-9H,1-5H3/t8-,9-/m1/s1.
What are the key properties of trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane?
trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane has a molecular weight of 138.25 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-1-methyl-2-propan-2-yl-3-propan-2-ylidenecyclopropane is sourced from PubChem (CID 91694383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).