3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol

C8H11F2N3O — CID 106174489

IUPAC3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol
SMILESNc1cccc(NCC(F)(F)CO)n1
InChIInChI=1S/C8H11F2N3O/c9-8(10,5-14)4-12-7-3-1-2-6(11)13-7/h1-3,14H,4-5H2,(H3,11,12,13)
InChIKeyCQKNKKFPSQWPDL-UHFFFAOYSA-N
MW203.19 g/mol
LogP0.70
Rot. Bonds4

About 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol

3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol (PubChem CID 106174489) has the molecular formula C8H11F2N3O and a molecular weight of 203.19 g/mol. Its IUPAC name is 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol.

Molecular Properties

Compound Name3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol
PubChem CID106174489
Molecular FormulaC8H11F2N3O
Molecular Weight203.19 g/mol
Exact Mass203.09
IUPAC Name3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol
SMILESNc1cccc(NCC(F)(F)CO)n1
InChIInChI=1S/C8H11F2N3O/c9-8(10,5-14)4-12-7-3-1-2-6(11)13-7/h1-3,14H,4-5H2,(H3,11,12,13)
InChIKeyCQKNKKFPSQWPDL-UHFFFAOYSA-N
XLogP0.70
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Launch Full Analysis

Related Compounds

2-[(6-amino-2-pyridinyl)amino]ethanol
CID 66907238
2,2-difluoro-3-(quinolin-2-ylamino)propan-1-ol
CID 104858613
3-[(4-aminopyrimidin-2-yl)amino]-2,2-difluoropropan-1-ol
CID 106174497
3-[(6-amino-2-pyridinyl)amino]-2,2-dimethylpropanamide
CID 106280453
3-[(6-amino-2-phenylpyrimidin-4-yl)amino]-2,2-difluoropropan-1-ol
CID 106179314
3-[[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]amino]-2,2-difluoropropan-1-ol
CID 106179444
3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-2,2-difluoropropan-1-ol
CID 106167469
4-[(6-amino-2-pyridinyl)amino]butan-1-ol
CID 106846869
3-[(6-amino-2-ethylpyrimidin-4-yl)amino]-2,2-difluoropropan-1-ol
CID 104925423
3-[(2,6-difluoropyrimidin-4-yl)amino]-2,2-difluoropropan-1-ol
CID 164647732
3-[[2-amino-6-(methylamino)pyrimidin-4-yl]amino]-2,2-difluoropropan-1-ol
CID 106179284
6-N-[2-(methylamino)ethyl]pyridine-2,6-diamine
CID 10888283

Frequently Asked Questions

What is the IUPAC name of 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol?
The IUPAC name of 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol (CID 106174489) is 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol.
What is the SMILES notation for 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol?
The canonical SMILES for 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol is Nc1cccc(NCC(F)(F)CO)n1.
What is the InChIKey of 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol?
The InChIKey is CQKNKKFPSQWPDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3O/c9-8(10,5-14)4-12-7-3-1-2-6(11)13-7/h1-3,14H,4-5H2,(H3,11,12,13).
What are the key properties of 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol?
3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol has a molecular weight of 203.19 g/mol, XLogP of 0.70, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-amino-2-pyridinyl)amino]-2,2-difluoropropan-1-ol is sourced from PubChem (CID 106174489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).