5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide

C17H21N3O — CID 104641246

IUPAC5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NC(C)Cc2ccccc2)nc1
InChIInChI=1S/C17H21N3O/c1-3-18-15-9-10-16(19-12-15)17(21)20-13(2)11-14-7-5-4-6-8-14/h4-10,12-13,18H,3,11H2,1-2H3,(H,20,21)
InChIKeyDDUCEFRWHICABO-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.87
Rot. Bonds6

About 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide

5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide (PubChem CID 104641246) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
PubChem CID104641246
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NC(C)Cc2ccccc2)nc1
InChIInChI=1S/C17H21N3O/c1-3-18-15-9-10-16(19-12-15)17(21)20-13(2)11-14-7-5-4-6-8-14/h4-10,12-13,18H,3,11H2,1-2H3,(H,20,21)
InChIKeyDDUCEFRWHICABO-UHFFFAOYSA-N
XLogP2.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-hydrazinyl-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
CID 113436344
5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
CID 81317136
5-(ethylamino)-N-(1-thiophen-2-ylpropan-2-yl)pyridine-2-carboxamide
CID 104641309
5-(ethylamino)-N-hexan-2-ylpyridine-2-carboxamide
CID 113436154
N-butan-2-yl-5-(propylamino)pyridine-2-carboxamide
CID 109179241
5-bromo-N-[1-(4-bromophenyl)propan-2-yl]pyridine-2-carboxamide
CID 62953884
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
N-butan-2-yl-5-(butylamino)pyridine-2-carboxamide
CID 109180814
5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide
CID 107643013
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104640844
N-[1-(3-bromophenyl)ethyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104640557
5-(ethylamino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 104640059

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide (CID 104641246) is 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide is CCNc1ccc(C(=O)NC(C)Cc2ccccc2)nc1.
What is the InChIKey of 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
The InChIKey is DDUCEFRWHICABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-3-18-15-9-10-16(19-12-15)17(21)20-13(2)11-14-7-5-4-6-8-14/h4-10,12-13,18H,3,11H2,1-2H3,(H,20,21).
What are the key properties of 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 104641246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).