3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol

C10H12F2N2O — CID 112675958

IUPAC3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol
SMILESOC1CC(CNc2ncc(F)cc2F)C1
InChIInChI=1S/C10H12F2N2O/c11-7-3-9(12)10(14-5-7)13-4-6-1-8(15)2-6/h3,5-6,8,15H,1-2,4H2,(H,13,14)
InChIKeyYYPORMMVISCOMC-UHFFFAOYSA-N
MW214.22 g/mol
LogP1.54
Rot. Bonds3

About 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol

3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol (PubChem CID 112675958) has the molecular formula C10H12F2N2O and a molecular weight of 214.22 g/mol. Its IUPAC name is 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol
PubChem CID112675958
Molecular FormulaC10H12F2N2O
Molecular Weight214.22 g/mol
Exact Mass214.09
IUPAC Name3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol
SMILESOC1CC(CNc2ncc(F)cc2F)C1
InChIInChI=1S/C10H12F2N2O/c11-7-3-9(12)10(14-5-7)13-4-6-1-8(15)2-6/h3,5-6,8,15H,1-2,4H2,(H,13,14)
InChIKeyYYPORMMVISCOMC-UHFFFAOYSA-N
XLogP1.54
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 106130548
[2-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 112675954
4-[[(5-bromo-3-fluoro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 106129928
3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
CID 107419343
N-[[2-(chloromethyl)cyclopentyl]methyl]-3,5-difluoropyridin-2-amine
CID 112676581
3-[[(6-fluoropyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 115417135
3-[(4-fluoroanilino)methyl]cyclobutan-1-ol
CID 126794071
3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol
CID 102984602
3,5-difluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 114617532
N-(3-chloropropyl)-3,5-difluoropyridin-2-amine
CID 112676550
3-[[[2-(ethylamino)-5-fluoropyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 106137925
N-[(4-aminocyclohexyl)methyl]-5-chloro-3-fluoropyridin-2-amine
CID 114147330

Frequently Asked Questions

What is the IUPAC name of 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol?
The IUPAC name of 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol (CID 112675958) is 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol.
What is the SMILES notation for 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol?
The canonical SMILES for 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol is OC1CC(CNc2ncc(F)cc2F)C1.
What is the InChIKey of 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol?
The InChIKey is YYPORMMVISCOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O/c11-7-3-9(12)10(14-5-7)13-4-6-1-8(15)2-6/h3,5-6,8,15H,1-2,4H2,(H,13,14).
What are the key properties of 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol?
3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol has a molecular weight of 214.22 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol is sourced from PubChem (CID 112675958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).