(3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol

C10H11Cl2NO2 — CID 79781092

IUPAC(3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol
SMILESOC(c1ncc(Cl)cc1Cl)C1CCOC1
InChIInChI=1S/C10H11Cl2NO2/c11-7-3-8(12)9(13-4-7)10(14)6-1-2-15-5-6/h3-4,6,10,14H,1-2,5H2
InChIKeyGRBCYQBVIGJLIY-UHFFFAOYSA-N
MW248.11 g/mol
LogP2.46
Rot. Bonds2

About (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol

(3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol (PubChem CID 79781092) has the molecular formula C10H11Cl2NO2 and a molecular weight of 248.11 g/mol. Its IUPAC name is (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol.

Molecular Properties

Compound Name(3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol
PubChem CID79781092
Molecular FormulaC10H11Cl2NO2
Molecular Weight248.11 g/mol
Exact Mass247.02
IUPAC Name(3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol
SMILESOC(c1ncc(Cl)cc1Cl)C1CCOC1
InChIInChI=1S/C10H11Cl2NO2/c11-7-3-8(12)9(13-4-7)10(14)6-1-2-15-5-6/h3-4,6,10,14H,1-2,5H2
InChIKeyGRBCYQBVIGJLIY-UHFFFAOYSA-N
XLogP2.46
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.11
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dichlorophenyl)-(oxolan-3-yl)methanol
CID 63899921
(2-chlorophenyl)-(oxolan-3-yl)methanol
CID 63564171
2-cyclohexyl-1-(3,5-dichloro-2-pyridinyl)ethanol
CID 79780362
5-chloro-3-fluoro-N-[1-(oxolan-3-yl)ethyl]pyridin-2-amine
CID 115681781
(5-chloro-3-pyridinyl)-(oxolan-3-yl)methanamine
CID 131115157
(3,5-dichloro-2-pyridinyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
CID 79781088
(4-chloro-2-methoxyphenyl)-(oxolan-3-yl)methanol
CID 115798171
1-(3,5-dichloro-2-pyridinyl)-N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 79912066
(2,5-dichlorophenyl)-(oxan-3-yl)methanol
CID 63013314
3-[chloro-(2,5-dichlorophenyl)methyl]oxolane
CID 61278920
(3-chloro-4,5-dimethoxyphenyl)-(oxolan-3-yl)methanol
CID 63563606
1-(3,5-dichloro-2-pyridinyl)-2-(oxan-4-yl)ethanone
CID 79785846

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol?
The IUPAC name of (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol (CID 79781092) is (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol.
What is the SMILES notation for (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol?
The canonical SMILES for (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol is OC(c1ncc(Cl)cc1Cl)C1CCOC1.
What is the InChIKey of (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol?
The InChIKey is GRBCYQBVIGJLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2NO2/c11-7-3-8(12)9(13-4-7)10(14)6-1-2-15-5-6/h3-4,6,10,14H,1-2,5H2.
What are the key properties of (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol?
(3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol has a molecular weight of 248.11 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-2-pyridinyl)-(oxolan-3-yl)methanol is sourced from PubChem (CID 79781092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).