[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol

C8H8ClF2NO2 — CID 130073877

IUPAC[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol
SMILESCOc1c(CO)cnc(C(F)F)c1Cl
InChIInChI=1S/C8H8ClF2NO2/c1-14-7-4(3-13)2-12-6(5(7)9)8(10)11/h2,8,13H,3H2,1H3
InChIKeyPWJHHBZZQVZRCV-UHFFFAOYSA-N
MW223.61 g/mol
LogP2.17
Rot. Bonds3

About [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol

[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol (PubChem CID 130073877) has the molecular formula C8H8ClF2NO2 and a molecular weight of 223.61 g/mol. Its IUPAC name is [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol
PubChem CID130073877
Molecular FormulaC8H8ClF2NO2
Molecular Weight223.61 g/mol
Exact Mass223.02
IUPAC Name[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol
SMILESCOc1c(CO)cnc(C(F)F)c1Cl
InChIInChI=1S/C8H8ClF2NO2/c1-14-7-4(3-13)2-12-6(5(7)9)8(10)11/h2,8,13H,3H2,1H3
InChIKeyPWJHHBZZQVZRCV-UHFFFAOYSA-N
XLogP2.17
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.61
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(bromomethyl)-3-chloro-2-(difluoromethyl)-4-methoxypyridine
CID 130073771
[5-chloro-6-(difluoromethyl)-4-fluoro-3-pyridinyl]methanol
CID 130071902
[6-(difluoromethyl)-4-methoxy-5-nitro-3-pyridinyl]methanol
CID 118809092
[4-bromo-5-chloro-6-(difluoromethyl)-3-pyridinyl]methanol
CID 118845394
[3-chloro-5-(difluoromethyl)-4-methoxy-2-pyridinyl]methanol
CID 130073890
[2-(difluoromethyl)-5-iodo-4-methoxy-3-pyridinyl]methanol
CID 118831773
5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide
CID 134686410
[5-chloro-2-(difluoromethyl)-3-methyl-4-pyridinyl]methanol
CID 130074320
2-[6-(difluoromethyl)-5-methoxy-4-methyl-3-pyridinyl]acetic acid
CID 118837312
[5,6-dichloro-4-(difluoromethyl)-3-pyridinyl]methanol
CID 119020401
[4-(chloromethyl)-2-(difluoromethyl)-5-methoxy-3-pyridinyl]methanol
CID 118840334
2-[4-bromo-6-(difluoromethyl)-5-methoxy-3-pyridinyl]acetic acid
CID 118805918

Frequently Asked Questions

What is the IUPAC name of [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol?
The IUPAC name of [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol (CID 130073877) is [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol.
What is the SMILES notation for [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol?
The canonical SMILES for [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol is COc1c(CO)cnc(C(F)F)c1Cl.
What is the InChIKey of [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol?
The InChIKey is PWJHHBZZQVZRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClF2NO2/c1-14-7-4(3-13)2-12-6(5(7)9)8(10)11/h2,8,13H,3H2,1H3.
What are the key properties of [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol?
[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol has a molecular weight of 223.61 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol is sourced from PubChem (CID 130073877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).