N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide

C17H20N2O3 — CID 23767035

IUPACN,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cccnc1Oc1ccc(OC)cc1
InChIInChI=1S/C17H20N2O3/c1-4-19(5-2)17(20)15-7-6-12-18-16(15)22-14-10-8-13(21-3)9-11-14/h6-12H,4-5H2,1-3H3
InChIKeyPKLNZBAWWHBBBJ-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.36
Rot. Bonds6

About N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide

N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide (PubChem CID 23767035) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide
PubChem CID23767035
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cccnc1Oc1ccc(OC)cc1
InChIInChI=1S/C17H20N2O3/c1-4-19(5-2)17(20)15-7-6-12-18-16(15)22-14-10-8-13(21-3)9-11-14/h6-12H,4-5H2,1-3H3
InChIKeyPKLNZBAWWHBBBJ-UHFFFAOYSA-N
XLogP3.36
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide (CID 23767035) is N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide is CCN(CC)C(=O)c1cccnc1Oc1ccc(OC)cc1.
What is the InChIKey of N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide?
The InChIKey is PKLNZBAWWHBBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-4-19(5-2)17(20)15-7-6-12-18-16(15)22-14-10-8-13(21-3)9-11-14/h6-12H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide?
N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 23767035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).