N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide

C14H25N3O3 — CID 63869969

IUPACN-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESNC1CCC(OCCNC(=O)CN2CCCC2=O)CC1
InChIInChI=1S/C14H25N3O3/c15-11-3-5-12(6-4-11)20-9-7-16-13(18)10-17-8-1-2-14(17)19/h11-12H,1-10,15H2,(H,16,18)
InChIKeyORVOHMAACLUVPA-UHFFFAOYSA-N
MW283.37 g/mol
LogP0.01
Rot. Bonds6

About N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide

N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 63869969) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID63869969
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC NameN-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESNC1CCC(OCCNC(=O)CN2CCCC2=O)CC1
InChIInChI=1S/C14H25N3O3/c15-11-3-5-12(6-4-11)20-9-7-16-13(18)10-17-8-1-2-14(17)19/h11-12H,1-10,15H2,(H,16,18)
InChIKeyORVOHMAACLUVPA-UHFFFAOYSA-N
XLogP0.01
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 94869868
N-[2-(2-methylprop-2-enoxy)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 115700259
N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide
CID 78874251
N-(4-aminocyclohexyl)-2-(2-oxoazocan-1-yl)acetamide;hydrochloride
CID 119478869
N-[(1-methylsulfonylpiperidin-4-yl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 131944173
N-(4-hydroxybutyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 106843150
2-(2-oxopiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86984731
N-(3-hydroxy-4-methoxybutyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 103876710
N-(2-hydroxyethyl)-2-(2-oxoazepan-1-yl)acetamide
CID 43388932
N-[2-(dimethylamino)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide;hydrochloride
CID 21327798
2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]-N-propylacetamide
CID 56810104
N-[2-(cycloheptylamino)ethyl]-2-(2-oxoazocan-1-yl)acetamide;hydrochloride
CID 119621354

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide (CID 63869969) is N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide is NC1CCC(OCCNC(=O)CN2CCCC2=O)CC1.
What is the InChIKey of N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is ORVOHMAACLUVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c15-11-3-5-12(6-4-11)20-9-7-16-13(18)10-17-8-1-2-14(17)19/h11-12H,1-10,15H2,(H,16,18).
What are the key properties of N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 283.37 g/mol, XLogP of 0.01, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 63869969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).