2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide

C19H25N3O — CID 120621513

IUPAC2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide
SMILESCC(NC(=O)Cc1ccc(N)cn1)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C19H25N3O/c1-13(14-5-7-15(8-6-14)19(2,3)4)22-18(23)11-17-10-9-16(20)12-21-17/h5-10,12-13H,11,20H2,1-4H3,(H,22,23)
InChIKeyDFCJROIJBJFTDG-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.38
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide

2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide (PubChem CID 120621513) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide
PubChem CID120621513
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide
SMILESCC(NC(=O)Cc1ccc(N)cn1)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C19H25N3O/c1-13(14-5-7-15(8-6-14)19(2,3)4)22-18(23)11-17-10-9-16(20)12-21-17/h5-10,12-13H,11,20H2,1-4H3,(H,22,23)
InChIKeyDFCJROIJBJFTDG-UHFFFAOYSA-N
XLogP3.38
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-2-pyridinyl)-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 120617873
2-(5-amino-2-pyridinyl)-N-[(1S)-1-phenylethyl]acetamide
CID 107338863
2-(5-amino-2-pyridinyl)-N-[1-(3,4-difluorophenyl)ethyl]acetamide
CID 107337738
2-(5-amino-2-pyridinyl)-N-[(1S)-1-(3-fluorophenyl)ethyl]acetamide
CID 107339328
2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 120622083
2-(5-amino-2-pyridinyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 120620251
N-[(1R)-1-(4-aminophenyl)ethyl]-2-(4-tert-butylphenoxy)acetamide
CID 58640419
2-(5-amino-2-pyridinyl)-N-tert-butylacetamide
CID 107337327
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]propanoic acid
CID 107338226
2-(5-amino-2-pyridinyl)-N-butan-2-ylacetamide
CID 107337332
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3,3-dimethylbutanoic acid
CID 107338218
2-(5-amino-2-pyridinyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 107338393

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide (CID 120621513) is 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide is CC(NC(=O)Cc1ccc(N)cn1)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide?
The InChIKey is DFCJROIJBJFTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-13(14-5-7-15(8-6-14)19(2,3)4)22-18(23)11-17-10-9-16(20)12-21-17/h5-10,12-13H,11,20H2,1-4H3,(H,22,23).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide?
2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide has a molecular weight of 311.43 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide is sourced from PubChem (CID 120621513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).