5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide

C20H27N3O — CID 109239408

IUPAC5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cncc(NC(C)(C)C)c1
InChIInChI=1S/C20H27N3O/c1-6-14-9-8-10-15(7-2)18(14)22-19(24)16-11-17(13-21-12-16)23-20(3,4)5/h8-13,23H,6-7H2,1-5H3,(H,22,24)
InChIKeySRPBPTLYHHJCFM-UHFFFAOYSA-N
MW325.46 g/mol
LogP4.67
Rot. Bonds5

About 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide

5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide (PubChem CID 109239408) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide
PubChem CID109239408
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cncc(NC(C)(C)C)c1
InChIInChI=1S/C20H27N3O/c1-6-14-9-8-10-15(7-2)18(14)22-19(24)16-11-17(13-21-12-16)23-20(3,4)5/h8-13,23H,6-7H2,1-5H3,(H,22,24)
InChIKeySRPBPTLYHHJCFM-UHFFFAOYSA-N
XLogP4.67
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-tert-butyl-3-N-(2,6-diethylphenyl)pyridine-3,5-dicarboxamide
CID 109106930
5-(tert-butylamino)-N-phenylpyridine-3-carboxamide
CID 109239388
N-(3-bromophenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239462
5-(tert-butylamino)-N-(2,3-dimethylphenyl)pyridine-3-carboxamide
CID 109239400
5-(2-cyanoanilino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 109243961
3-N-(2,6-diethylphenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106761
N-(2,6-diethylphenyl)-3-(2,2-dimethylpropanoylamino)benzamide
CID 35339689
N-(4-bromophenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239425
N-(4-acetylphenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239442
5-(tert-butylamino)-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
CID 109239451
5-(tert-butylamino)-N-(2-tert-butylphenyl)pyridine-3-carboxamide
CID 109239410
5-(4-acetamidoanilino)-N-(2-ethyl-6-methylphenyl)pyridine-3-carboxamide
CID 109243693

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide (CID 109239408) is 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide is CCc1cccc(CC)c1NC(=O)c1cncc(NC(C)(C)C)c1.
What is the InChIKey of 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
The InChIKey is SRPBPTLYHHJCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-6-14-9-8-10-15(7-2)18(14)22-19(24)16-11-17(13-21-12-16)23-20(3,4)5/h8-13,23H,6-7H2,1-5H3,(H,22,24).
What are the key properties of 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide has a molecular weight of 325.46 g/mol, XLogP of 4.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109239408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).