6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine

C15H14ClFN2O2 — CID 82717728

IUPAC6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine
SMILESNc1ccc(Oc2ccc(Cl)c(F)c2)nc1OCC1CC1
InChIInChI=1S/C15H14ClFN2O2/c16-11-4-3-10(7-12(11)17)21-14-6-5-13(18)15(19-14)20-8-9-1-2-9/h3-7,9H,1-2,8,18H2
InChIKeyDNBWXCGCGQDVHD-UHFFFAOYSA-N
MW308.74 g/mol
LogP4.04
Rot. Bonds5

About 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine

6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine (PubChem CID 82717728) has the molecular formula C15H14ClFN2O2 and a molecular weight of 308.74 g/mol. Its IUPAC name is 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine
PubChem CID82717728
Molecular FormulaC15H14ClFN2O2
Molecular Weight308.74 g/mol
Exact Mass308.07
IUPAC Name6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine
SMILESNc1ccc(Oc2ccc(Cl)c(F)c2)nc1OCC1CC1
InChIInChI=1S/C15H14ClFN2O2/c16-11-4-3-10(7-12(11)17)21-14-6-5-13(18)15(19-14)20-8-9-1-2-9/h3-7,9H,1-2,8,18H2
InChIKeyDNBWXCGCGQDVHD-UHFFFAOYSA-N
XLogP4.04
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.74
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine?
The IUPAC name of 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine (CID 82717728) is 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine.
What is the SMILES notation for 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine?
The canonical SMILES for 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine is Nc1ccc(Oc2ccc(Cl)c(F)c2)nc1OCC1CC1.
What is the InChIKey of 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine?
The InChIKey is DNBWXCGCGQDVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O2/c16-11-4-3-10(7-12(11)17)21-14-6-5-13(18)15(19-14)20-8-9-1-2-9/h3-7,9H,1-2,8,18H2.
What are the key properties of 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine?
6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine has a molecular weight of 308.74 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chloro-3-fluorophenoxy)-2-(cyclopropylmethoxy)pyridin-3-amine is sourced from PubChem (CID 82717728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).