N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide

C17H21N3O — CID 82733988

IUPACN-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide
SMILESCCc1cccnc1CNC(=O)c1ccc(C)cc1NC
InChIInChI=1S/C17H21N3O/c1-4-13-6-5-9-19-16(13)11-20-17(21)14-8-7-12(2)10-15(14)18-3/h5-10,18H,4,11H2,1-3H3,(H,20,21)
InChIKeyHHAAJELZJSZCMZ-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.92
Rot. Bonds5

About N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide

N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide (PubChem CID 82733988) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide
PubChem CID82733988
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC NameN-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide
SMILESCCc1cccnc1CNC(=O)c1ccc(C)cc1NC
InChIInChI=1S/C17H21N3O/c1-4-13-6-5-9-19-16(13)11-20-17(21)14-8-7-12(2)10-15(14)18-3/h5-10,18H,4,11H2,1-3H3,(H,20,21)
InChIKeyHHAAJELZJSZCMZ-UHFFFAOYSA-N
XLogP2.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide
CID 105070941
N-[(3-ethyl-2-pyridinyl)methyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 82734476
N-[(3-ethyl-2-pyridinyl)methyl]-4-(methylamino)benzamide
CID 82743343
2,6-dichloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 106994204
N-[(3-ethyl-2-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 82744064
N-[(3-ethyl-2-pyridinyl)methyl]-2H-triazole-4-carboxamide
CID 82748926
2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-5-fluorobenzamide
CID 82741369
2-amino-5-chloro-N-[(3-ethyl-2-pyridinyl)methyl]benzamide
CID 82741526
2-bromo-N-[(3-ethyl-2-pyridinyl)methyl]furan-3-carboxamide
CID 106854223
2-amino-5-bromo-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 82743986
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
5-methyl-2-(methylamino)-N-[(2-methylphenyl)methyl]benzamide
CID 62509176

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide?
The IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide (CID 82733988) is N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide is CCc1cccnc1CNC(=O)c1ccc(C)cc1NC.
What is the InChIKey of N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide?
The InChIKey is HHAAJELZJSZCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-4-13-6-5-9-19-16(13)11-20-17(21)14-8-7-12(2)10-15(14)18-3/h5-10,18H,4,11H2,1-3H3,(H,20,21).
What are the key properties of N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide?
N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide has a molecular weight of 283.38 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 82733988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).