N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide

C17H24N4O4 — CID 95636491

IUPACN-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide
SMILESNC(=O)NC(=O)CNc1ccccc1C(=O)N1CCCC[C@@H]1CCO
InChIInChI=1S/C17H24N4O4/c18-17(25)20-15(23)11-19-14-7-2-1-6-13(14)16(24)21-9-4-3-5-12(21)8-10-22/h1-2,6-7,12,19,22H,3-5,8-11H2,(H3,18,20,23,25)/t12-/m1/s1
InChIKeyZWJJOONXWXDPMR-GFCCVEGCSA-N
MW348.40 g/mol
LogP0.67
Rot. Bonds6

About N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide

N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide (PubChem CID 95636491) has the molecular formula C17H24N4O4 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide
PubChem CID95636491
Molecular FormulaC17H24N4O4
Molecular Weight348.40 g/mol
Exact Mass348.18
IUPAC NameN-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide
SMILESNC(=O)NC(=O)CNc1ccccc1C(=O)N1CCCC[C@@H]1CCO
InChIInChI=1S/C17H24N4O4/c18-17(25)20-15(23)11-19-14-7-2-1-6-13(14)16(24)21-9-4-3-5-12(21)8-10-22/h1-2,6-7,12,19,22H,3-5,8-11H2,(H3,18,20,23,25)/t12-/m1/s1
InChIKeyZWJJOONXWXDPMR-GFCCVEGCSA-N
XLogP0.67
TPSA124.76 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 50.67
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(propylamino)phenyl]-(2-propylpiperidin-1-yl)methanone
CID 83044104
[2-(ethylamino)phenyl]-[2-(3-hydroxypropyl)pyrrolidin-1-yl]methanone
CID 62479621
[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]phenyl]methanone
CID 95981882
[2-(ethylamino)phenyl]-(2-ethylazepan-1-yl)methanone
CID 104690846
2-amino-N-[2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetyl]benzamide
CID 108529491
2,3-dihydro-1,4-benzodioxin-5-yl-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 60955013
[5-chloro-2-(ethylamino)phenyl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62166978
2-[2-[2-(hydroxymethyl)pyrrolidine-1-carbonyl]anilino]-N-[(4-methylphenyl)methyl]acetamide
CID 136524722
[2-(hydroxymethyl)azepan-1-yl]-[2-(propan-2-ylamino)phenyl]methanone
CID 116635542
N-(2-fluorophenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetamide
CID 108520894
[2-(cyclopropylamino)-3-pyridinyl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 84574317
(5-amino-2-bromo-4-fluorophenyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62814891

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide?
The IUPAC name of N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide (CID 95636491) is N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide?
The canonical SMILES for N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide is NC(=O)NC(=O)CNc1ccccc1C(=O)N1CCCC[C@@H]1CCO.
What is the InChIKey of N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide?
The InChIKey is ZWJJOONXWXDPMR-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H24N4O4/c18-17(25)20-15(23)11-19-14-7-2-1-6-13(14)16(24)21-9-4-3-5-12(21)8-10-22/h1-2,6-7,12,19,22H,3-5,8-11H2,(H3,18,20,23,25)/t12-/m1/s1.
What are the key properties of N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide?
N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide has a molecular weight of 348.40 g/mol, XLogP of 0.67, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide is sourced from PubChem (CID 95636491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).