N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide

C23H25N3O — CID 109189083

IUPACN-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(NC(C)c2ccccc2)cn1)c1cccc(C)c1
InChIInChI=1S/C23H25N3O/c1-4-26(21-12-8-9-17(2)15-21)23(27)22-14-13-20(16-24-22)25-18(3)19-10-6-5-7-11-19/h5-16,18,25H,4H2,1-3H3
InChIKeyDTHYISUFTHDSOM-UHFFFAOYSA-N
MW359.47 g/mol
LogP5.23
Rot. Bonds6

About N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide

N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide (PubChem CID 109189083) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide
PubChem CID109189083
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(NC(C)c2ccccc2)cn1)c1cccc(C)c1
InChIInChI=1S/C23H25N3O/c1-4-26(21-12-8-9-17(2)15-21)23(27)22-14-13-20(16-24-22)25-18(3)19-10-6-5-7-11-19/h5-16,18,25H,4H2,1-3H3
InChIKeyDTHYISUFTHDSOM-UHFFFAOYSA-N
XLogP5.23
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-phenyl-5-(1-phenylethylamino)pyridine-2-carboxamide
CID 109189023
N-ethyl-N-(3-methylphenyl)-6-(1-phenylethylamino)pyridazine-3-carboxamide
CID 109118810
N-ethyl-N-(3-methylphenyl)-5-(propan-2-ylamino)pyrazine-2-carboxamide
CID 109271545
N-ethyl-5-[(4-methoxyphenyl)methylamino]-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109190548
5-(dipropylamino)-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109196689
5-(tert-butylamino)-N-ethyl-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109287454
N-ethyl-5-(3-methylanilino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109290010
5-(benzylamino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109188045
5-(3-bromoanilino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109198518
N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide
CID 109182897
5-(3-acetylanilino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109198506
N-ethyl-5-(pentylamino)-N-phenylpyridine-2-carboxamide
CID 109195842

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide (CID 109189083) is N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide is CCN(C(=O)c1ccc(NC(C)c2ccccc2)cn1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide?
The InChIKey is DTHYISUFTHDSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-4-26(21-12-8-9-17(2)15-21)23(27)22-14-13-20(16-24-22)25-18(3)19-10-6-5-7-11-19/h5-16,18,25H,4H2,1-3H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide?
N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 5.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109189083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).