[6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol

C8H10F2N2O — CID 118831070

IUPAC[6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol
SMILESNCc1ncc(CO)cc1C(F)F
InChIInChI=1S/C8H10F2N2O/c9-8(10)6-1-5(4-13)3-12-7(6)2-11/h1,3,8,13H,2,4,11H2
InChIKeyLOOBJGJGXFQELV-UHFFFAOYSA-N
MW188.18 g/mol
LogP0.97
Rot. Bonds3

About [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol

[6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol (PubChem CID 118831070) has the molecular formula C8H10F2N2O and a molecular weight of 188.18 g/mol. Its IUPAC name is [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol
PubChem CID118831070
Molecular FormulaC8H10F2N2O
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name[6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol
SMILESNCc1ncc(CO)cc1C(F)F
InChIInChI=1S/C8H10F2N2O/c9-8(10)6-1-5(4-13)3-12-7(6)2-11/h1,3,8,13H,2,4,11H2
InChIKeyLOOBJGJGXFQELV-UHFFFAOYSA-N
XLogP0.97
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(difluoromethyl)-6-methyl-3-pyridinyl]methanol
CID 130097700
[5-(difluoromethyl)-3,4-diiodo-2-pyridinyl]methanamine
CID 118848069
[5-(difluoromethyl)-4-fluoro-2-pyridinyl]methanol
CID 130096445
[5-(difluoromethyl)-6-methyl-3-pyridinyl]methanamine
CID 130097556
[6-(aminomethyl)-5-(difluoromethyl)-2-methyl-3-pyridinyl]methanol
CID 118847964
[5-(aminomethyl)-4-(difluoromethyl)-2-pyridinyl]methanol
CID 130098028
[6-(aminomethyl)-3-(difluoromethyl)-5-methoxy-2-pyridinyl]methanol
CID 118831446
2-(difluoromethyl)-5-(hydroxymethyl)pyridin-3-ol
CID 118820519
[5-(difluoromethyl)-4-fluoro-3-iodo-2-pyridinyl]methanol
CID 130080189
[6-(aminomethyl)-4-(difluoromethyl)-5-iodo-2-pyridinyl]methanol
CID 130086878
4-amino-2-(aminomethyl)-5-(difluoromethyl)pyridine-3-carbaldehyde
CID 118805849
[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol
CID 130088446

Frequently Asked Questions

What is the IUPAC name of [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol (CID 118831070) is [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol is NCc1ncc(CO)cc1C(F)F.
What is the InChIKey of [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol?
The InChIKey is LOOBJGJGXFQELV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O/c9-8(10)6-1-5(4-13)3-12-7(6)2-11/h1,3,8,13H,2,4,11H2.
What are the key properties of [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol?
[6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol has a molecular weight of 188.18 g/mol, XLogP of 0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(aminomethyl)-5-(difluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 118831070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).