4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide

C16H26N4O — CID 63361068

IUPAC4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide
SMILESCCNC(=O)c1ccc(N)c(NCCN2CCCCC2)c1
InChIInChI=1S/C16H26N4O/c1-2-18-16(21)13-6-7-14(17)15(12-13)19-8-11-20-9-4-3-5-10-20/h6-7,12,19H,2-5,8-11,17H2,1H3,(H,18,21)
InChIKeyGBSVWSCJHZFEHT-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.92
Rot. Bonds6

About 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide

4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide (PubChem CID 63361068) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide.

Molecular Properties

Compound Name4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide
PubChem CID63361068
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide
SMILESCCNC(=O)c1ccc(N)c(NCCN2CCCCC2)c1
InChIInChI=1S/C16H26N4O/c1-2-18-16(21)13-6-7-14(17)15(12-13)19-8-11-20-9-4-3-5-10-20/h6-7,12,19H,2-5,8-11,17H2,1H3,(H,18,21)
InChIKeyGBSVWSCJHZFEHT-UHFFFAOYSA-N
XLogP1.92
TPSA70.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-amino-N-ethyl-4-(2-thiomorpholin-4-ylethylamino)benzamide
CID 106324843
4-amino-3-(2-cyclopentylethylamino)-N-ethylbenzamide
CID 63360616
4-amino-3-[2-(carbamoylamino)ethylamino]-N-ethylbenzamide
CID 83116178
3-amino-N-methyl-4-(2-pyrrolidin-1-ylethylamino)benzamide
CID 82988789
4-amino-3-[(4-amino-4-oxobutyl)amino]-N-ethylbenzamide
CID 63361145
2-[2-amino-5-(ethylcarbamoyl)anilino]ethyl carbamate
CID 83201801
4-amino-3-(2-ethoxyethylamino)-N-ethylbenzamide
CID 55190007
4-amino-N-ethyl-3-(3-methoxypropylamino)benzamide
CID 63360956
4-amino-N-ethyl-3-[(1-methylcyclopentyl)methylamino]benzamide
CID 63820564
4-fluoro-2-N-(2-piperidin-1-ylethyl)benzene-1,2-diamine
CID 62377830
4-amino-N-ethyl-3-(2-pyridin-4-ylethylamino)benzamide
CID 63360526
3,4-dimethyl-N-(2-piperidin-1-ylethyl)benzamide
CID 25237097

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide?
The IUPAC name of 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide (CID 63361068) is 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide.
What is the SMILES notation for 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide?
The canonical SMILES for 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide is CCNC(=O)c1ccc(N)c(NCCN2CCCCC2)c1.
What is the InChIKey of 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide?
The InChIKey is GBSVWSCJHZFEHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-2-18-16(21)13-6-7-14(17)15(12-13)19-8-11-20-9-4-3-5-10-20/h6-7,12,19H,2-5,8-11,17H2,1H3,(H,18,21).
What are the key properties of 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide?
4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide has a molecular weight of 290.41 g/mol, XLogP of 1.92, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-3-(2-piperidin-1-ylethylamino)benzamide is sourced from PubChem (CID 63361068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).