2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide

C17H27N3O — CID 78987037

IUPAC2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESCC(C)(C)NCC(=O)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C17H27N3O/c1-17(2,3)18-13-16(21)19-14-9-5-6-10-15(14)20-11-7-4-8-12-20/h5-6,9-10,18H,4,7-8,11-13H2,1-3H3,(H,19,21)
InChIKeyKAODEHPVNSOURH-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.00
Rot. Bonds4

About 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide

2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide (PubChem CID 78987037) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide
PubChem CID78987037
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESCC(C)(C)NCC(=O)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C17H27N3O/c1-17(2,3)18-13-16(21)19-14-9-5-6-10-15(14)20-11-7-4-8-12-20/h5-6,9-10,18H,4,7-8,11-13H2,1-3H3,(H,19,21)
InChIKeyKAODEHPVNSOURH-UHFFFAOYSA-N
XLogP3.00
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-piperidin-1-ylphenyl)propanamide
CID 960826
2-anilino-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 119399959
3,3-dimethyl-5-oxo-5-(2-piperidin-1-ylanilino)pentanoate
CID 6926722
2-(cyclopentylamino)-N-(2-piperidin-1-ylphenyl)acetamide
CID 43816730
2-amino-N-(2-piperidin-1-ylphenyl)acetamide;dihydrochloride
CID 119828044
2-(2-methoxyethylamino)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 78913422
3-amino-N-[2-(azepan-1-yl)phenyl]propanamide;dihydrochloride
CID 119842100
2-[2-(azepan-1-yl)anilino]-N-(tert-butylcarbamoyl)acetamide
CID 36588357
2-methyl-N-[2-oxo-2-(2-pyrrolidin-1-ylanilino)ethyl]benzamide
CID 46526099
2-(3-methylbutylamino)-N-(2-piperidin-1-ylphenyl)acetamide;oxalic acid
CID 171668727
1-(2-methylphenyl)-3-(2-piperidin-1-ylphenyl)urea
CID 2814230
N-[2-(azepan-1-yl)phenyl]-2-(2-piperidin-1-ylethylamino)acetamide;oxalic acid
CID 175652876

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide (CID 78987037) is 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide is CC(C)(C)NCC(=O)Nc1ccccc1N1CCCCC1.
What is the InChIKey of 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide?
The InChIKey is KAODEHPVNSOURH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-17(2,3)18-13-16(21)19-14-9-5-6-10-15(14)20-11-7-4-8-12-20/h5-6,9-10,18H,4,7-8,11-13H2,1-3H3,(H,19,21).
What are the key properties of 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide?
2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide has a molecular weight of 289.42 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-(2-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 78987037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).