4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide

C14H15N3O2 — CID 63358470

IUPAC4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide
SMILESCN(C)C(=O)c1ccc(N)c(Oc2cccnc2)c1
InChIInChI=1S/C14H15N3O2/c1-17(2)14(18)10-5-6-12(15)13(8-10)19-11-4-3-7-16-9-11/h3-9H,15H2,1-2H3
InChIKeyXBKBAZFLULLUPV-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.16
Rot. Bonds3

About 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide

4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide (PubChem CID 63358470) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide.

Molecular Properties

Compound Name4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide
PubChem CID63358470
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide
SMILESCN(C)C(=O)c1ccc(N)c(Oc2cccnc2)c1
InChIInChI=1S/C14H15N3O2/c1-17(2)14(18)10-5-6-12(15)13(8-10)19-11-4-3-7-16-9-11/h3-9H,15H2,1-2H3
InChIKeyXBKBAZFLULLUPV-UHFFFAOYSA-N
XLogP2.16
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-N,N-dimethyl-3-[(2-methylpropan-2-yl)oxy]benzamide
CID 63358733
4-amino-3-(2,4-dibromophenoxy)-N,N-dimethylbenzamide
CID 64720406
3-amino-N,N-dimethyl-4-(3-methylphenoxy)benzamide
CID 82993412
N,N-dimethylpyridine-3-carboxamide;ethane
CID 142562125
N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide
CID 174921681
4,5-dimethoxy-2-pyridin-3-yloxyaniline
CID 83008307
4-amino-N,N-dimethyl-3-(1-phenylethoxy)benzamide
CID 63358467
6-pyridin-3-yloxy-2,3-dihydro-1,4-benzodioxin-7-amine
CID 43144876
1-(3-chloro-4-pyridin-3-yloxyphenyl)ethanone
CID 55130531
1-(3-bromo-4-pyridin-3-yloxyphenyl)ethanone
CID 62908521
3-amino-N,N-dimethyl-4-pyridin-3-yloxybenzenesulfonamide
CID 43162717
5-fluoro-4-methyl-2-pyridin-3-yloxyaniline
CID 103590987

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide?
The IUPAC name of 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide (CID 63358470) is 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide.
What is the SMILES notation for 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide?
The canonical SMILES for 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide is CN(C)C(=O)c1ccc(N)c(Oc2cccnc2)c1.
What is the InChIKey of 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide?
The InChIKey is XBKBAZFLULLUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-17(2)14(18)10-5-6-12(15)13(8-10)19-11-4-3-7-16-9-11/h3-9H,15H2,1-2H3.
What are the key properties of 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide?
4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide has a molecular weight of 257.29 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N-dimethyl-3-pyridin-3-yloxybenzamide is sourced from PubChem (CID 63358470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).