6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide

C15H14N2O3 — CID 22087205

IUPAC6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
SMILESCC(=O)Cc1ccc(Oc2ccc(C(N)=O)cn2)cc1
InChIInChI=1S/C15H14N2O3/c1-10(18)8-11-2-5-13(6-3-11)20-14-7-4-12(9-17-14)15(16)19/h2-7,9H,8H2,1H3,(H2,16,19)
InChIKeyWQIKBKXJHGJQBA-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.10
Rot. Bonds5

About 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide

6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide (PubChem CID 22087205) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
PubChem CID22087205
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
SMILESCC(=O)Cc1ccc(Oc2ccc(C(N)=O)cn2)cc1
InChIInChI=1S/C15H14N2O3/c1-10(18)8-11-2-5-13(6-3-11)20-14-7-4-12(9-17-14)15(16)19/h2-7,9H,8H2,1H3,(H2,16,19)
InChIKeyWQIKBKXJHGJQBA-UHFFFAOYSA-N
XLogP2.10
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91553748
6-[4-[(2R)-2-aminopropyl]phenoxy]pyridine-3-carboxamide;hydrochloride
CID 22087128
6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415252
6-(4-hydroxyphenoxy)pyridine-3-carboxamide
CID 60868756
6-[4-(3-amino-2-methylpropyl)phenoxy]pyridine-3-carboxamide
CID 174444884
6-[4-[[(4-methoxyphenyl)methylamino]methyl]phenoxy]pyridine-3-carboxamide
CID 68745018
6-[4-(1-aminopropyl)phenoxy]pyridine-3-carboxamide
CID 174444828
6-[4-[[(2S)-3,3-dimethyl-2-phenylazetidin-1-yl]methyl]phenoxy]pyridine-3-carboxamide
CID 56849551
4-[[5-[(propan-2-ylamino)methyl]-2-pyridinyl]oxy]benzamide
CID 80637430
6-[4-[3-(2-phenylethylamino)propyl]phenoxy]pyridine-3-carboxamide
CID 68748065
6-[4-[3-[(4-methoxyphenyl)methylamino]butyl]phenoxy]pyridine-3-carboxamide
CID 68746356
6-[4-[2-methyl-2-(2-phenylethylamino)propyl]phenoxy]pyridine-3-carboxamide
CID 68746672

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide?
The IUPAC name of 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide (CID 22087205) is 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide is CC(=O)Cc1ccc(Oc2ccc(C(N)=O)cn2)cc1.
What is the InChIKey of 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide?
The InChIKey is WQIKBKXJHGJQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-10(18)8-11-2-5-13(6-3-11)20-14-7-4-12(9-17-14)15(16)19/h2-7,9H,8H2,1H3,(H2,16,19).
What are the key properties of 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide?
6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 22087205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).