N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide

C17H29N3O3 — CID 29230052

IUPACN-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESO=C(CN1CCCC1=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C17H29N3O3/c21-15(13-19-8-4-5-16(19)22)18-14-17(6-2-1-3-7-17)20-9-11-23-12-10-20/h1-14H2,(H,18,21)
InChIKeyDBMIIXNVGZLGNT-UHFFFAOYSA-N
MW323.44 g/mol
LogP0.76
Rot. Bonds5

About N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide

N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 29230052) has the molecular formula C17H29N3O3 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID29230052
Molecular FormulaC17H29N3O3
Molecular Weight323.44 g/mol
Exact Mass323.22
IUPAC NameN-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESO=C(CN1CCCC1=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C17H29N3O3/c21-15(13-19-8-4-5-16(19)22)18-14-17(6-2-1-3-7-17)20-9-11-23-12-10-20/h1-14H2,(H,18,21)
InChIKeyDBMIIXNVGZLGNT-UHFFFAOYSA-N
XLogP0.76
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide (CID 29230052) is N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide is O=C(CN1CCCC1=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is DBMIIXNVGZLGNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O3/c21-15(13-19-8-4-5-16(19)22)18-14-17(6-2-1-3-7-17)20-9-11-23-12-10-20/h1-14H2,(H,18,21).
What are the key properties of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 323.44 g/mol, XLogP of 0.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 29230052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).