6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide

C19H18N4O2 — CID 67439353

IUPAC6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide
SMILESCCc1ccc(C(N)=O)c(Oc2ccc(Nc3ccccn3)cc2)n1
InChIInChI=1S/C19H18N4O2/c1-2-13-8-11-16(18(20)24)19(23-13)25-15-9-6-14(7-10-15)22-17-5-3-4-12-21-17/h3-12H,2H2,1H3,(H2,20,24)(H,21,22)
InChIKeyRYFNCKXSKYPEDV-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.67
Rot. Bonds6

About 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide

6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide (PubChem CID 67439353) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide
PubChem CID67439353
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide
SMILESCCc1ccc(C(N)=O)c(Oc2ccc(Nc3ccccn3)cc2)n1
InChIInChI=1S/C19H18N4O2/c1-2-13-8-11-16(18(20)24)19(23-13)25-15-9-6-14(7-10-15)22-17-5-3-4-12-21-17/h3-12H,2H2,1H3,(H2,20,24)(H,21,22)
InChIKeyRYFNCKXSKYPEDV-UHFFFAOYSA-N
XLogP3.67
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide?
The IUPAC name of 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide (CID 67439353) is 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide is CCc1ccc(C(N)=O)c(Oc2ccc(Nc3ccccn3)cc2)n1.
What is the InChIKey of 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide?
The InChIKey is RYFNCKXSKYPEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-2-13-8-11-16(18(20)24)19(23-13)25-15-9-6-14(7-10-15)22-17-5-3-4-12-21-17/h3-12H,2H2,1H3,(H2,20,24)(H,21,22).
What are the key properties of 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide?
6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 67439353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).