4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide

C15H15N3O2 — CID 142886612

IUPAC4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide
SMILESC=C(N)c1ccc(Oc2ccnc(C(=O)NC)c2)cc1
InChIInChI=1S/C15H15N3O2/c1-10(16)11-3-5-12(6-4-11)20-13-7-8-18-14(9-13)15(19)17-2/h3-9H,1,16H2,2H3,(H,17,19)
InChIKeyDKEIYARVSSEYRE-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.16
Rot. Bonds4

About 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide

4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide (PubChem CID 142886612) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide
PubChem CID142886612
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide
SMILESC=C(N)c1ccc(Oc2ccnc(C(=O)NC)c2)cc1
InChIInChI=1S/C15H15N3O2/c1-10(16)11-3-5-12(6-4-11)20-13-7-8-18-14(9-13)15(19)17-2/h3-9H,1,16H2,2H3,(H,17,19)
InChIKeyDKEIYARVSSEYRE-UHFFFAOYSA-N
XLogP2.16
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[4-[N-carbamoyl-4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]anilino]phenoxy]-N-methylpyridine-2-carboxamide
CID 23614583
4-[4-[[(3,4-dimethylbenzoyl)amino]carbamoyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 11212255
4-(4-aminophenoxy)-N-methylpyridine-2-carboxamide;methyl 4-(4-aminophenoxy)pyridine-2-carboxylate
CID 162090161
4-(4-amino-3-methylphenoxy)-N-methylpyridine-2-carboxamide;hydrochloride
CID 66746840
N-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]carbamate
CID 86648443
2-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]acetic acid
CID 61395400
4-[4-(2,3-dimethylpent-1-en-3-yl)phenoxy]-N-methylpyridine-2-carboxamide
CID 123648832
4-[4-[[(3-hydroxy-4-methylbenzoyl)amino]carbamoyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 143062062
4-[4-[(4-hydroxyphenyl)diazenyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 165438064
ethyl N-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]carbamate
CID 138110037
4-(2-aminoquinolin-6-yl)oxy-N-methylpyridine-2-carboxamide
CID 71019360
4-[3-[[(4-methoxybenzoyl)amino]carbamoyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 58858348

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide (CID 142886612) is 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide is C=C(N)c1ccc(Oc2ccnc(C(=O)NC)c2)cc1.
What is the InChIKey of 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide?
The InChIKey is DKEIYARVSSEYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-10(16)11-3-5-12(6-4-11)20-13-7-8-18-14(9-13)15(19)17-2/h3-9H,1,16H2,2H3,(H,17,19).
What are the key properties of 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide?
4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1-aminoethenyl)phenoxy]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 142886612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).