4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide

C15H17N3O — CID 62184718

IUPAC4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide
SMILESCCNc1ccc(C(=O)NCc2cccnc2)cc1
InChIInChI=1S/C15H17N3O/c1-2-17-14-7-5-13(6-8-14)15(19)18-11-12-4-3-9-16-10-12/h3-10,17H,2,11H2,1H3,(H,18,19)
InChIKeyNDKQAGSBELZGDD-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.44
Rot. Bonds5

About 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide

4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 62184718) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide
PubChem CID62184718
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide
SMILESCCNc1ccc(C(=O)NCc2cccnc2)cc1
InChIInChI=1S/C15H17N3O/c1-2-17-14-7-5-13(6-8-14)15(19)18-11-12-4-3-9-16-10-12/h3-10,17H,2,11H2,1H3,(H,18,19)
InChIKeyNDKQAGSBELZGDD-UHFFFAOYSA-N
XLogP2.44
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(ethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 104639627
4-N-(4-tert-butylphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047675
4-N-(4-acetamidophenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047706
N-[(4-fluorophenyl)methyl]-4-(pyridin-3-ylmethylamino)benzamide
CID 51086157
4-[4-(propanoylamino)phenyl]-N-(pyridin-3-ylmethyl)benzamide
CID 153360745
4-ethoxy-N-(pyridin-3-ylmethyl)benzamide
CID 673607
4-(aminomethyl)-N-(pyridin-3-ylmethyl)benzamide
CID 28545926
4-N-(4-fluorophenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047677
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
4-propan-2-ylsulfanyl-N-(pyridin-3-ylmethyl)benzamide
CID 47265352
4-tert-butyl-N-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]benzamide
CID 27554699
4-N-(3-chloro-4-methylphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047684

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide (CID 62184718) is 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide is CCNc1ccc(C(=O)NCc2cccnc2)cc1.
What is the InChIKey of 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is NDKQAGSBELZGDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-2-17-14-7-5-13(6-8-14)15(19)18-11-12-4-3-9-16-10-12/h3-10,17H,2,11H2,1H3,(H,18,19).
What are the key properties of 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide?
4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 255.32 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 62184718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).