2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide

C16H26N4O — CID 79323412

IUPAC2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide
SMILESCN(CCNC(=O)CN1CCC(N)CC1)c1ccccc1
InChIInChI=1S/C16H26N4O/c1-19(15-5-3-2-4-6-15)12-9-18-16(21)13-20-10-7-14(17)8-11-20/h2-6,14H,7-13,17H2,1H3,(H,18,21)
InChIKeyHICXAHVNDCRIJC-UHFFFAOYSA-N
MW290.41 g/mol
LogP0.66
Rot. Bonds6

About 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide

2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide (PubChem CID 79323412) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide
PubChem CID79323412
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide
SMILESCN(CCNC(=O)CN1CCC(N)CC1)c1ccccc1
InChIInChI=1S/C16H26N4O/c1-19(15-5-3-2-4-6-15)12-9-18-16(21)13-20-10-7-14(17)8-11-20/h2-6,14H,7-13,17H2,1H3,(H,18,21)
InChIKeyHICXAHVNDCRIJC-UHFFFAOYSA-N
XLogP0.66
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-[2-[ethyl(methyl)amino]ethyl]acetamide
CID 79328337
N-[3-(N-methylanilino)propyl]-2-piperazin-1-ylacetamide
CID 29008728
2-(4-acetylpiperazin-1-yl)-N-[3-(N-methylanilino)propyl]acetamide
CID 25344786
N-[2-(N-methylanilino)ethyl]-2-piperidin-4-ylacetamide
CID 61260106
3-(cyclopropylamino)-N-[2-(N-methylanilino)ethyl]propanamide
CID 61259203
4-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-[2-(N-methylanilino)ethyl]piperazine-1-carboxamide
CID 78831358
2-(4-aminopiperidin-1-yl)-N-[4-[methyl(propan-2-yl)amino]butyl]acetamide
CID 79328181
N-[3-(N-methylanilino)propyl]-2-(3-pyrrolidin-1-ylpiperidin-1-yl)acetamide
CID 60504127
N-[3-(N-methylanilino)propyl]-2-[4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]piperazin-1-yl]acetamide
CID 30964057
3-amino-N-[2-(N-methylanilino)ethyl]butanamide
CID 61258847
2-(4-aminopiperidin-1-yl)-N-(1-phenylethyl)acetamide
CID 43556855
2-(3-acetamidopiperidin-1-yl)-N-[3-(N-methylanilino)propyl]acetamide
CID 60503613

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide (CID 79323412) is 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide is CN(CCNC(=O)CN1CCC(N)CC1)c1ccccc1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide?
The InChIKey is HICXAHVNDCRIJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-19(15-5-3-2-4-6-15)12-9-18-16(21)13-20-10-7-14(17)8-11-20/h2-6,14H,7-13,17H2,1H3,(H,18,21).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide?
2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide has a molecular weight of 290.41 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-[2-(N-methylanilino)ethyl]acetamide is sourced from PubChem (CID 79323412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).