6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide

C17H21N3O — CID 62171187

IUPAC6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccc(C(C)C)cc2)cn1
InChIInChI=1S/C17H21N3O/c1-4-18-16-10-7-14(11-19-16)17(21)20-15-8-5-13(6-9-15)12(2)3/h5-12H,4H2,1-3H3,(H,18,19)(H,20,21)
InChIKeyMDHNVTRVVJAUSW-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.89
Rot. Bonds5

About 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide

6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 62171187) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
PubChem CID62171187
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccc(C(C)C)cc2)cn1
InChIInChI=1S/C17H21N3O/c1-4-18-16-10-7-14(11-19-16)17(21)20-15-8-5-13(6-9-15)12(2)3/h5-12H,4H2,1-3H3,(H,18,19)(H,20,21)
InChIKeyMDHNVTRVVJAUSW-UHFFFAOYSA-N
XLogP3.89
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 ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-methylbutylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109161164
6-(ethylamino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 62166937
6-(ethylamino)-N-(4-iodophenyl)pyridine-3-carboxamide
CID 62166329
4-(ethylamino)-N-(4-propan-2-ylphenyl)benzamide
CID 62171719
6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
CID 62181500
N-(3-chloro-4-methylphenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 62184769
N-(3,5-dichloro-4-fluorophenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 107578414
N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide
CID 115268582
N-(4-propan-2-ylphenyl)-2-(propylamino)pyrimidine-5-carboxamide
CID 109246773
4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 60732249
2-(2-methylpropylamino)-N-(4-propan-2-ylphenyl)pyrimidine-5-carboxamide
CID 109248729

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide (CID 62171187) is 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide is CCNc1ccc(C(=O)Nc2ccc(C(C)C)cc2)cn1.
What is the InChIKey of 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
The InChIKey is MDHNVTRVVJAUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-4-18-16-10-7-14(11-19-16)17(21)20-15-8-5-13(6-9-15)12(2)3/h5-12H,4H2,1-3H3,(H,18,19)(H,20,21).
What are the key properties of 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide?
6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 3.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62171187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).