N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine

C10H10F2N4 — CID 112675617

IUPACN-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine
SMILESCCn1cc(Nc2ncc(F)cc2F)cn1
InChIInChI=1S/C10H10F2N4/c1-2-16-6-8(5-14-16)15-10-9(12)3-7(11)4-13-10/h3-6H,2H2,1H3,(H,13,15)
InChIKeyKYABLHCXOIBOHT-UHFFFAOYSA-N
MW224.21 g/mol
LogP2.32
Rot. Bonds3

About N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine

N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine (PubChem CID 112675617) has the molecular formula C10H10F2N4 and a molecular weight of 224.21 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine
PubChem CID112675617
Molecular FormulaC10H10F2N4
Molecular Weight224.21 g/mol
Exact Mass224.09
IUPAC NameN-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine
SMILESCCn1cc(Nc2ncc(F)cc2F)cn1
InChIInChI=1S/C10H10F2N4/c1-2-16-6-8(5-14-16)15-10-9(12)3-7(11)4-13-10/h3-6H,2H2,1H3,(H,13,15)
InChIKeyKYABLHCXOIBOHT-UHFFFAOYSA-N
XLogP2.32
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.21
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine (CID 112675617) is N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine is CCn1cc(Nc2ncc(F)cc2F)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine?
The InChIKey is KYABLHCXOIBOHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N4/c1-2-16-6-8(5-14-16)15-10-9(12)3-7(11)4-13-10/h3-6H,2H2,1H3,(H,13,15).
What are the key properties of N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine?
N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine has a molecular weight of 224.21 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-3,5-difluoropyridin-2-amine is sourced from PubChem (CID 112675617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).