1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol

C10H17FO — CID 130913875

IUPAC1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)C1(C)CC1F
InChIInChI=1S/C10H17FO/c1-3-4-7-5-10(7,12)9(2)6-8(9)11/h7-8,12H,3-6H2,1-2H3
InChIKeyYEHWOTZPCLVFQN-UHFFFAOYSA-N
MW172.24 g/mol
LogP2.29
Rot. Bonds3

About 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol

1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol (PubChem CID 130913875) has the molecular formula C10H17FO and a molecular weight of 172.24 g/mol. Its IUPAC name is 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol
PubChem CID130913875
Molecular FormulaC10H17FO
Molecular Weight172.24 g/mol
Exact Mass172.13
IUPAC Name1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)C1(C)CC1F
InChIInChI=1S/C10H17FO/c1-3-4-7-5-10(7,12)9(2)6-8(9)11/h7-8,12H,3-6H2,1-2H3
InChIKeyYEHWOTZPCLVFQN-UHFFFAOYSA-N
XLogP2.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.24
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol?
The IUPAC name of 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol (CID 130913875) is 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol.
What is the SMILES notation for 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol?
The canonical SMILES for 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol is CCCC1CC1(O)C1(C)CC1F.
What is the InChIKey of 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol?
The InChIKey is YEHWOTZPCLVFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17FO/c1-3-4-7-5-10(7,12)9(2)6-8(9)11/h7-8,12H,3-6H2,1-2H3.
What are the key properties of 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol?
1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol has a molecular weight of 172.24 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-1-methylcyclopropyl)-2-propylcyclopropan-1-ol is sourced from PubChem (CID 130913875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).