3-(1-pyridin-3-ylethylamino)benzamide

C14H15N3O — CID 43202862

IUPAC3-(1-pyridin-3-ylethylamino)benzamide
SMILESCC(Nc1cccc(C(N)=O)c1)c1cccnc1
InChIInChI=1S/C14H15N3O/c1-10(12-5-3-7-16-9-12)17-13-6-2-4-11(8-13)14(15)18/h2-10,17H,1H3,(H2,15,18)
InChIKeyZCHJBRLAWQVKNK-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.35
Rot. Bonds4

About 3-(1-pyridin-3-ylethylamino)benzamide

3-(1-pyridin-3-ylethylamino)benzamide (PubChem CID 43202862) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-(1-pyridin-3-ylethylamino)benzamide.

Molecular Properties

Compound Name3-(1-pyridin-3-ylethylamino)benzamide
PubChem CID43202862
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name3-(1-pyridin-3-ylethylamino)benzamide
SMILESCC(Nc1cccc(C(N)=O)c1)c1cccnc1
InChIInChI=1S/C14H15N3O/c1-10(12-5-3-7-16-9-12)17-13-6-2-4-11(8-13)14(15)18/h2-10,17H,1H3,(H2,15,18)
InChIKeyZCHJBRLAWQVKNK-UHFFFAOYSA-N
XLogP2.35
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-pyridin-3-ylethylamino)benzenesulfonamide
CID 43193566
3-[1-(4-hydroxyphenyl)ethylamino]benzamide
CID 43202853
N-methyl-4-(1-pyridin-3-ylethylamino)benzamide
CID 43683661
3-[1-(4-ethylphenyl)ethylamino]benzamide
CID 43202914
2-fluoro-4-(1-pyridin-3-ylethylamino)benzenecarbothioamide
CID 115367935
3-[1-(1,3-thiazol-4-yl)ethylamino]benzamide
CID 115928538
tert-butyl N-[[3-(1-pyridin-3-ylethylamino)phenyl]methyl]carbamate
CID 113354942
4-[[(1S)-1-pyridin-3-ylethyl]sulfamoyl]benzamide
CID 92520306
methyl 2-(3-carbamoylanilino)propanoate
CID 66174696
3-(1-pyridin-3-ylethylcarbamoyl)benzoic acid
CID 43523910
5-amino-6-(1-pyridin-3-ylethylamino)pyridine-2-carboxamide
CID 114405461
3,4,5-trifluoro-N-(1-pyridin-3-ylethyl)aniline
CID 62810175

Frequently Asked Questions

What is the IUPAC name of 3-(1-pyridin-3-ylethylamino)benzamide?
The IUPAC name of 3-(1-pyridin-3-ylethylamino)benzamide (CID 43202862) is 3-(1-pyridin-3-ylethylamino)benzamide.
What is the SMILES notation for 3-(1-pyridin-3-ylethylamino)benzamide?
The canonical SMILES for 3-(1-pyridin-3-ylethylamino)benzamide is CC(Nc1cccc(C(N)=O)c1)c1cccnc1.
What is the InChIKey of 3-(1-pyridin-3-ylethylamino)benzamide?
The InChIKey is ZCHJBRLAWQVKNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10(12-5-3-7-16-9-12)17-13-6-2-4-11(8-13)14(15)18/h2-10,17H,1H3,(H2,15,18).
What are the key properties of 3-(1-pyridin-3-ylethylamino)benzamide?
3-(1-pyridin-3-ylethylamino)benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-pyridin-3-ylethylamino)benzamide is sourced from PubChem (CID 43202862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).