3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine

C15H16FN3O2 — CID 91765729

IUPAC3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine
SMILESFc1cnccc1N[C@@H]1COCC[C@H]1Oc1ccccn1
InChIInChI=1S/C15H16FN3O2/c16-11-9-17-7-4-12(11)19-13-10-20-8-5-14(13)21-15-3-1-2-6-18-15/h1-4,6-7,9,13-14H,5,8,10H2,(H,17,19)/t13-,14-/m1/s1
InChIKeyUMKLQSDFPWBMRG-ZIAGYGMSSA-N
MW289.31 g/mol
LogP2.26
Rot. Bonds4

About 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine

3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine (PubChem CID 91765729) has the molecular formula C15H16FN3O2 and a molecular weight of 289.31 g/mol. Its IUPAC name is 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine.

Molecular Properties

Compound Name3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine
PubChem CID91765729
Molecular FormulaC15H16FN3O2
Molecular Weight289.31 g/mol
Exact Mass289.12
IUPAC Name3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine
SMILESFc1cnccc1N[C@@H]1COCC[C@H]1Oc1ccccn1
InChIInChI=1S/C15H16FN3O2/c16-11-9-17-7-4-12(11)19-13-10-20-8-5-14(13)21-15-3-1-2-6-18-15/h1-4,6-7,9,13-14H,5,8,10H2,(H,17,19)/t13-,14-/m1/s1
InChIKeyUMKLQSDFPWBMRG-ZIAGYGMSSA-N
XLogP2.26
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine with MolForge

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Related Compounds

4-[(3R,4R)-3-[(3-fluoro-4-pyridinyl)amino]oxan-4-yl]oxybenzoic acid
CID 91792650
6-cyclopropyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidin-4-amine
CID 91771738
1,1-di(propan-2-yl)-3-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]urea
CID 91777188
N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]-1H-pyrazole-4-carboxamide
CID 91773229
N-[2-oxo-2-[(4-pyridin-2-yloxyoxan-3-yl)amino]ethyl]benzamide
CID 156608743
N-cyclopropyl-2-[[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]amino]pyridine-4-carboxamide
CID 91761162
2-phenylmethoxy-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]acetamide
CID 91761107
2-propan-2-ylsulfonyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]acetamide
CID 91766386
1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide
CID 91795536
3-(methanesulfonamido)-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]propanamide
CID 91792493
3-chloro-N-[(3S,4R)-3-pyridin-2-yloxyoxan-4-yl]pyridin-2-amine
CID 91773034
2-(dimethylamino)-4-methyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidine-5-carboxamide
CID 91791524

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine?
The IUPAC name of 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine (CID 91765729) is 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine.
What is the SMILES notation for 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine?
The canonical SMILES for 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine is Fc1cnccc1N[C@@H]1COCC[C@H]1Oc1ccccn1.
What is the InChIKey of 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine?
The InChIKey is UMKLQSDFPWBMRG-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H16FN3O2/c16-11-9-17-7-4-12(11)19-13-10-20-8-5-14(13)21-15-3-1-2-6-18-15/h1-4,6-7,9,13-14H,5,8,10H2,(H,17,19)/t13-,14-/m1/s1.
What are the key properties of 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine?
3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine has a molecular weight of 289.31 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyridin-4-amine is sourced from PubChem (CID 91765729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).