5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine

C9H10F2N2O — CID 123838873

IUPAC5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine
SMILESNc1ccc(OCC2CC2(F)F)cn1
InChIInChI=1S/C9H10F2N2O/c10-9(11)3-6(9)5-14-7-1-2-8(12)13-4-7/h1-2,4,6H,3,5H2,(H2,12,13)
InChIKeyPUBCOJHDXQYRTQ-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.70
Rot. Bonds3

About 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine

5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine (PubChem CID 123838873) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine.

Molecular Properties

Compound Name5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine
PubChem CID123838873
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine
SMILESNc1ccc(OCC2CC2(F)F)cn1
InChIInChI=1S/C9H10F2N2O/c10-9(11)3-6(9)5-14-7-1-2-8(12)13-4-7/h1-2,4,6H,3,5H2,(H2,12,13)
InChIKeyPUBCOJHDXQYRTQ-UHFFFAOYSA-N
XLogP1.70
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine?
The IUPAC name of 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine (CID 123838873) is 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine.
What is the SMILES notation for 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine?
The canonical SMILES for 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine is Nc1ccc(OCC2CC2(F)F)cn1.
What is the InChIKey of 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine?
The InChIKey is PUBCOJHDXQYRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c10-9(11)3-6(9)5-14-7-1-2-8(12)13-4-7/h1-2,4,6H,3,5H2,(H2,12,13).
What are the key properties of 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine?
5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine has a molecular weight of 200.19 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine is sourced from PubChem (CID 123838873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).