2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene

C9H14S — CID 129270882

IUPAC2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene
SMILESC[C@@H]1CC1C1(C)CC=CS1
InChIInChI=1S/C9H14S/c1-7-6-8(7)9(2)4-3-5-10-9/h3,5,7-8H,4,6H2,1-2H3/t7-,8?,9?/m1/s1
InChIKeyMNSNABALBPOLTD-AFPNSQJFSA-N
MW154.28 g/mol
LogP3.05
Rot. Bonds1

About 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene

2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene (PubChem CID 129270882) has the molecular formula C9H14S and a molecular weight of 154.28 g/mol. Its IUPAC name is 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene.

Molecular Properties

Compound Name2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene
PubChem CID129270882
Molecular FormulaC9H14S
Molecular Weight154.28 g/mol
Exact Mass154.08
IUPAC Name2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene
SMILESC[C@@H]1CC1C1(C)CC=CS1
InChIInChI=1S/C9H14S/c1-7-6-8(7)9(2)4-3-5-10-9/h3,5,7-8H,4,6H2,1-2H3/t7-,8?,9?/m1/s1
InChIKeyMNSNABALBPOLTD-AFPNSQJFSA-N
XLogP3.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.28
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene?
The IUPAC name of 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene (CID 129270882) is 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene.
What is the SMILES notation for 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene?
The canonical SMILES for 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene is C[C@@H]1CC1C1(C)CC=CS1.
What is the InChIKey of 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene?
The InChIKey is MNSNABALBPOLTD-AFPNSQJFSA-N. The full InChI is InChI=1S/C9H14S/c1-7-6-8(7)9(2)4-3-5-10-9/h3,5,7-8H,4,6H2,1-2H3/t7-,8?,9?/m1/s1.
What are the key properties of 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene?
2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene has a molecular weight of 154.28 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2R)-2-methylcyclopropyl]-3H-thiophene is sourced from PubChem (CID 129270882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).