[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol

C8H10F2N2O2 — CID 119022056

IUPAC[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol
SMILESCOc1c(N)ncc(C(F)F)c1CO
InChIInChI=1S/C8H10F2N2O2/c1-14-6-5(3-13)4(7(9)10)2-12-8(6)11/h2,7,13H,3H2,1H3,(H2,11,12)
InChIKeyKJRQUWNAYMITRJ-UHFFFAOYSA-N
MW204.18 g/mol
LogP1.10
Rot. Bonds3

About [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol

[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol (PubChem CID 119022056) has the molecular formula C8H10F2N2O2 and a molecular weight of 204.18 g/mol. Its IUPAC name is [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol
PubChem CID119022056
Molecular FormulaC8H10F2N2O2
Molecular Weight204.18 g/mol
Exact Mass204.07
IUPAC Name[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol
SMILESCOc1c(N)ncc(C(F)F)c1CO
InChIInChI=1S/C8H10F2N2O2/c1-14-6-5(3-13)4(7(9)10)2-12-8(6)11/h2,7,13H,3H2,1H3,(H2,11,12)
InChIKeyKJRQUWNAYMITRJ-UHFFFAOYSA-N
XLogP1.10
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.18
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]acetic acid
CID 118996845
[2-amino-5-(difluoromethyl)-3-(trifluoromethoxy)-4-pyridinyl]methanol
CID 118999909
[5-(difluoromethyl)-3-methoxy-2-nitro-4-pyridinyl]methanol
CID 133100024
[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol
CID 130087925
[3-chloro-5-(difluoromethyl)-4-methoxy-2-pyridinyl]methanol
CID 130073890
[5-(difluoromethyl)-3-methoxy-2-(trifluoromethyl)-4-pyridinyl]methanamine
CID 133084912
[2-(difluoromethyl)-5-iodo-4-methoxy-3-pyridinyl]methanol
CID 118831773
ethyl 2-[5-(difluoromethyl)-2-fluoro-3-methoxy-4-pyridinyl]acetate
CID 133105547
2-[4-(aminomethyl)-5-(difluoromethyl)-3-methoxy-2-pyridinyl]acetic acid
CID 118846731
[5-(difluoromethyl)-3-methoxy-2-nitro-4-pyridinyl]methanamine
CID 133100289
2-amino-4-(aminomethyl)-5-(difluoromethyl)pyridin-3-ol
CID 118997020
[5-(difluoromethyl)-4-fluoro-2-iodo-3-pyridinyl]methanol
CID 130080191

Frequently Asked Questions

What is the IUPAC name of [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol?
The IUPAC name of [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol (CID 119022056) is [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol.
What is the SMILES notation for [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol?
The canonical SMILES for [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol is COc1c(N)ncc(C(F)F)c1CO.
What is the InChIKey of [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol?
The InChIKey is KJRQUWNAYMITRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O2/c1-14-6-5(3-13)4(7(9)10)2-12-8(6)11/h2,7,13H,3H2,1H3,(H2,11,12).
What are the key properties of [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol?
[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol has a molecular weight of 204.18 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol is sourced from PubChem (CID 119022056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).