5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine

C10H12F2N2O2 — CID 134305017

IUPAC5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine
SMILESCNc1ccc(C(F)F)c(C2OCCO2)n1
InChIInChI=1S/C10H12F2N2O2/c1-13-7-3-2-6(9(11)12)8(14-7)10-15-4-5-16-10/h2-3,9-10H,4-5H2,1H3,(H,13,14)
InChIKeyQGWGKEWMIMIASQ-UHFFFAOYSA-N
MW230.21 g/mol
LogP2.11
Rot. Bonds3

About 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine

5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine (PubChem CID 134305017) has the molecular formula C10H12F2N2O2 and a molecular weight of 230.21 g/mol. Its IUPAC name is 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine
PubChem CID134305017
Molecular FormulaC10H12F2N2O2
Molecular Weight230.21 g/mol
Exact Mass230.09
IUPAC Name5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine
SMILESCNc1ccc(C(F)F)c(C2OCCO2)n1
InChIInChI=1S/C10H12F2N2O2/c1-13-7-3-2-6(9(11)12)8(14-7)10-15-4-5-16-10/h2-3,9-10H,4-5H2,1H3,(H,13,14)
InChIKeyQGWGKEWMIMIASQ-UHFFFAOYSA-N
XLogP2.11
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.21
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine?
The IUPAC name of 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine (CID 134305017) is 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine.
What is the SMILES notation for 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine?
The canonical SMILES for 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine is CNc1ccc(C(F)F)c(C2OCCO2)n1.
What is the InChIKey of 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine?
The InChIKey is QGWGKEWMIMIASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O2/c1-13-7-3-2-6(9(11)12)8(14-7)10-15-4-5-16-10/h2-3,9-10H,4-5H2,1H3,(H,13,14).
What are the key properties of 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine?
5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine has a molecular weight of 230.21 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-N-methylpyridin-2-amine is sourced from PubChem (CID 134305017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).