N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide

C13H25N3O3 — CID 112542079

IUPACN-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CC(NC(C)=O)CC(C(C)O)C1
InChIInChI=1S/C13H25N3O3/c1-9(17)12-6-13(15-11(3)19)8-16(7-12)5-4-14-10(2)18/h9,12-13,17H,4-8H2,1-3H3,(H,14,18)(H,15,19)
InChIKeyOZDILDOSEWUJCS-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.67
Rot. Bonds5

About N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide

N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide (PubChem CID 112542079) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide
PubChem CID112542079
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC NameN-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CC(NC(C)=O)CC(C(C)O)C1
InChIInChI=1S/C13H25N3O3/c1-9(17)12-6-13(15-11(3)19)8-16(7-12)5-4-14-10(2)18/h9,12-13,17H,4-8H2,1-3H3,(H,14,18)(H,15,19)
InChIKeyOZDILDOSEWUJCS-UHFFFAOYSA-N
XLogP-0.67
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-ethyl-5-(1-hydroxyethyl)piperidin-3-yl]acetamide
CID 112541682
N-[1-(2-acetamidoethyl)-5-propan-2-ylpiperidin-3-yl]-2,2-dimethylpropanamide
CID 112542523
N-[2-(3,4-dihydroxypyrrolidin-1-yl)ethyl]acetamide
CID 106672120
N-[2-[3-methyl-5-(methylamino)piperidin-1-yl]ethyl]acetamide
CID 83990134
N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide
CID 83994814
1-(2-acetamidoethyl)-5-(3-methylbutylamino)piperidine-3-carboxylic acid
CID 83996201
N-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]acetamide
CID 126999485
3-[3-(ethylamino)-5-(1-hydroxyethyl)piperidin-1-yl]propanoic acid
CID 83990640
methyl N-[1-(2-acetamidoethyl)-5-ethylpiperidin-3-yl]carbamate
CID 112543606
N-[5-(1-hydroxyethyl)-1-(2-methylpropyl)piperidin-3-yl]-2,2-dimethylpropanamide
CID 112542165
1-[5-(ethylamino)-1-(2-hydroxyethyl)piperidin-3-yl]ethanol
CID 83990738
methyl N-[1-(2-acetamidoethyl)-5-propylpiperidin-3-yl]carbamate
CID 112543607

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide (CID 112542079) is N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide is CC(=O)NCCN1CC(NC(C)=O)CC(C(C)O)C1.
What is the InChIKey of N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide?
The InChIKey is OZDILDOSEWUJCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-9(17)12-6-13(15-11(3)19)8-16(7-12)5-4-14-10(2)18/h9,12-13,17H,4-8H2,1-3H3,(H,14,18)(H,15,19).
What are the key properties of N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide?
N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide has a molecular weight of 271.36 g/mol, XLogP of -0.67, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide is sourced from PubChem (CID 112542079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).