2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide

C15H23N3O2 — CID 60959224

IUPAC2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide
SMILESCN1CCC(N(CCO)C(=O)c2ccccc2N)CC1
InChIInChI=1S/C15H23N3O2/c1-17-8-6-12(7-9-17)18(10-11-19)15(20)13-4-2-3-5-14(13)16/h2-5,12,19H,6-11,16H2,1H3
InChIKeyOWXMAALXUUMNPG-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.80
Rot. Bonds4

About 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide

2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide (PubChem CID 60959224) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide
PubChem CID60959224
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide
SMILESCN1CCC(N(CCO)C(=O)c2ccccc2N)CC1
InChIInChI=1S/C15H23N3O2/c1-17-8-6-12(7-9-17)18(10-11-19)15(20)13-4-2-3-5-14(13)16/h2-5,12,19H,6-11,16H2,1H3
InChIKeyOWXMAALXUUMNPG-UHFFFAOYSA-N
XLogP0.80
TPSA69.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Bentazon
CID 2328
2-Amino-N-isopropylbenzamide
CID 94411
(2-Aminophenyl)(pyrrolidin-1-yl)methanone
CID 713136
2-Amino-N-[3-(morpholin-4-yl)propyl]benzamide
CID 2306528
2-amino-N-(1-phenylethyl)benzamide
CID 2797236
2-amino-N-benzylbenzamide
CID 230755
2-(Morpholine-4-carbonyl)aniline
CID 726276
2-amino-N,N-diethylbenzamide
CID 10104045
4-amino-N-(2-hydroxyethyl)benzamide
CID 458761
2-Piperidinobenzamide
CID 335067
N-(2-hydroxyethyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 5295122
2-amino-N-(2-phenylethyl)benzamide
CID 723290

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide?
The IUPAC name of 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide (CID 60959224) is 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide is CN1CCC(N(CCO)C(=O)c2ccccc2N)CC1.
What is the InChIKey of 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide?
The InChIKey is OWXMAALXUUMNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-17-8-6-12(7-9-17)18(10-11-19)15(20)13-4-2-3-5-14(13)16/h2-5,12,19H,6-11,16H2,1H3.
What are the key properties of 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide?
2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide has a molecular weight of 277.37 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide is sourced from PubChem (CID 60959224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).