N-(3-amino-4-pyridinyl)-4-ethylbenzamide

C14H15N3O — CID 63062261

IUPACN-(3-amino-4-pyridinyl)-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccncc2N)cc1
InChIInChI=1S/C14H15N3O/c1-2-10-3-5-11(6-4-10)14(18)17-13-7-8-16-9-12(13)15/h3-9H,2,15H2,1H3,(H,16,17,18)
InChIKeyMHJJKOCLJCKUNQ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.48
Rot. Bonds3

About N-(3-amino-4-pyridinyl)-4-ethylbenzamide

N-(3-amino-4-pyridinyl)-4-ethylbenzamide (PubChem CID 63062261) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-(3-amino-4-pyridinyl)-4-ethylbenzamide.

Molecular Properties

Compound NameN-(3-amino-4-pyridinyl)-4-ethylbenzamide
PubChem CID63062261
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-(3-amino-4-pyridinyl)-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccncc2N)cc1
InChIInChI=1S/C14H15N3O/c1-2-10-3-5-11(6-4-10)14(18)17-13-7-8-16-9-12(13)15/h3-9H,2,15H2,1H3,(H,16,17,18)
InChIKeyMHJJKOCLJCKUNQ-UHFFFAOYSA-N
XLogP2.48
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-pyridinyl)-4-tert-butylbenzamide
CID 63063621
N-(3-amino-4-pyridinyl)-4-[[(4-fluorophenyl)methylcarbamoylamino]methyl]benzamide
CID 44594972
4-ethyl-N-pyridin-4-ylbenzamide
CID 2712552
N-(3-amino-4-pyridinyl)-3,4-difluorobenzamide
CID 63061741
N-(3-amino-4-pyridinyl)-4-[[(4-nitrophenyl)methylcarbamoylamino]methyl]benzamide
CID 44594969
N-(3-amino-4-pyridinyl)-1H-pyrazole-4-carboxamide
CID 63084907
4-(bromomethyl)-N-(3-fluoro-4-pyridinyl)benzamide
CID 107594820
N-(3-amino-2-methylphenyl)-4-ethylbenzamide
CID 18072928
N-(3-amino-4-pyridinyl)-4-[[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]methyl]benzamide
CID 44594108
4-(aminomethyl)-N-(4-methyl-3-pyridinyl)benzamide
CID 63326435
N-(4-amino-2,5-dichlorophenyl)-4-ethylbenzamide
CID 50881110
N-[[4-[(3-amino-4-pyridinyl)carbamoyl]phenyl]methyl]-3,4-dihydronaphthalene-2-carboxamide
CID 123309364

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-pyridinyl)-4-ethylbenzamide?
The IUPAC name of N-(3-amino-4-pyridinyl)-4-ethylbenzamide (CID 63062261) is N-(3-amino-4-pyridinyl)-4-ethylbenzamide.
What is the SMILES notation for N-(3-amino-4-pyridinyl)-4-ethylbenzamide?
The canonical SMILES for N-(3-amino-4-pyridinyl)-4-ethylbenzamide is CCc1ccc(C(=O)Nc2ccncc2N)cc1.
What is the InChIKey of N-(3-amino-4-pyridinyl)-4-ethylbenzamide?
The InChIKey is MHJJKOCLJCKUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-2-10-3-5-11(6-4-10)14(18)17-13-7-8-16-9-12(13)15/h3-9H,2,15H2,1H3,(H,16,17,18).
What are the key properties of N-(3-amino-4-pyridinyl)-4-ethylbenzamide?
N-(3-amino-4-pyridinyl)-4-ethylbenzamide has a molecular weight of 241.29 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-pyridinyl)-4-ethylbenzamide is sourced from PubChem (CID 63062261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).