1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol

C11H14BrNO — CID 79332467

IUPAC1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)c1cncc(Br)c1
InChIInChI=1S/C11H14BrNO/c1-2-3-8-5-11(8,14)9-4-10(12)7-13-6-9/h4,6-8,14H,2-3,5H2,1H3
InChIKeyBMRHPFCZACVWFE-UHFFFAOYSA-N
MW256.14 g/mol
LogP2.85
Rot. Bonds3

About 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol

1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol (PubChem CID 79332467) has the molecular formula C11H14BrNO and a molecular weight of 256.14 g/mol. Its IUPAC name is 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol
PubChem CID79332467
Molecular FormulaC11H14BrNO
Molecular Weight256.14 g/mol
Exact Mass255.03
IUPAC Name1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)c1cncc(Br)c1
InChIInChI=1S/C11H14BrNO/c1-2-3-8-5-11(8,14)9-4-10(12)7-13-6-9/h4,6-8,14H,2-3,5H2,1H3
InChIKeyBMRHPFCZACVWFE-UHFFFAOYSA-N
XLogP2.85
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.14
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromo-3-pyridinyl)-2-ethylcyclopropan-1-ol
CID 79332912
1-(3-bromo-4-methylphenyl)-2-propylcyclopropan-1-ol
CID 81488604
1-(3-bromo-4-fluorophenyl)-2-propylcyclopropan-1-ol
CID 107957841
1-(4-chlorophenyl)-2-propylcyclopropan-1-ol
CID 79333879
1-(2,5-dibromothiophen-3-yl)-2-propylcyclopropan-1-ol
CID 107965698
3-bromo-5-(2-methyloxiran-2-yl)pyridine
CID 102567804
3-bromo-5-[(2R)-2-methyloxiran-2-yl]pyridine
CID 99981022
1-(3-fluoro-4-pyridinyl)-2-propylcyclopropan-1-ol
CID 79333295
1-(2-methyltriazol-4-yl)-2-propylcyclopropan-1-ol
CID 130521199
1-(3-bromo-5-chlorophenyl)-2-ethylcyclopropan-1-ol
CID 107957835
1-(5-bromo-3-pyridinyl)cyclohexan-1-ol
CID 121282621
1-(2-bromo-6-fluorophenyl)-2-propylcyclopropan-1-ol
CID 114560911

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol?
The IUPAC name of 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol (CID 79332467) is 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol.
What is the SMILES notation for 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol?
The canonical SMILES for 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol is CCCC1CC1(O)c1cncc(Br)c1.
What is the InChIKey of 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol?
The InChIKey is BMRHPFCZACVWFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrNO/c1-2-3-8-5-11(8,14)9-4-10(12)7-13-6-9/h4,6-8,14H,2-3,5H2,1H3.
What are the key properties of 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol?
1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol has a molecular weight of 256.14 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-pyridinyl)-2-propylcyclopropan-1-ol is sourced from PubChem (CID 79332467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).