2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone

C13H24N2O3 — CID 114119064

IUPAC2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone
SMILESCOC1CC(NCC(=O)N2CCOCC2)C1(C)C
InChIInChI=1S/C13H24N2O3/c1-13(2)10(8-11(13)17-3)14-9-12(16)15-4-6-18-7-5-15/h10-11,14H,4-9H2,1-3H3
InChIKeyAIXCXTNLHNQXNA-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.25
Rot. Bonds4

About 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone

2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone (PubChem CID 114119064) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone
PubChem CID114119064
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone
SMILESCOC1CC(NCC(=O)N2CCOCC2)C1(C)C
InChIInChI=1S/C13H24N2O3/c1-13(2)10(8-11(13)17-3)14-9-12(16)15-4-6-18-7-5-15/h10-11,14H,4-9H2,1-3H3
InChIKeyAIXCXTNLHNQXNA-UHFFFAOYSA-N
XLogP0.25
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-Ethoxy-2,2-dimethylcyclobutyl)-propylamino]acetamide
CID 72003117
N-{[1-(methoxymethyl)cyclobutyl]methyl}-2-morpholin-4-ylacetamide
CID 124207283
1-(2,6-Dimethylmorpholin-4-yl)-2-[(2,2,5,5-tetramethyloxolan-3-yl)amino]ethanone
CID 136532898
2-[2-(2,2-Dimethylpropyl)morpholin-4-yl]-2-oxoacetamide
CID 20792963
1-[2-[(1R)-1-amino-3,3-dimethylbutyl]morpholin-4-yl]ethanone
CID 132113121
1-[2-(1-Amino-3,3-dimethylbutyl)morpholin-4-yl]ethanone
CID 132113122
2-(diethylamino)-N-[3-[1-[2,4-dimethyl-5-(methylamino)pentyl]piperidin-4-yl]oxycyclobutyl]acetamide
CID 139356811
N-[2-(3-aminopiperidin-4-yl)oxyethyl]-3,3-dimethylbutanamide
CID 140644022
ethane;2-[4-(2-methoxyethyl)piperazin-1-yl]-N-[3-[1-[2,2,4-trimethyl-5-(methylamino)pentyl]piperidin-4-yl]oxycyclobutyl]acetamide
CID 142368277
N-[3-[1-[4-amino-2-methyl-5-(propylamino)pentyl]piperidin-4-yl]oxycyclobutyl]-2-[4-(2-methoxyethyl)piperazin-1-yl]acetamide;ethane
CID 142368332
N-[3-[1-[4-amino-2-methyl-5-(propylamino)pentyl]piperidin-4-yl]oxycyclobutyl]-2-[4-(2-methoxyethyl)piperazin-1-yl]acetamide
CID 142368333
N-[3-[1-[2,4-dimethyl-5-(methylamino)pentyl]piperidin-4-yl]oxycyclobutyl]-2-[4-(2-methoxyethyl)piperazin-1-yl]acetamide;ethane
CID 142385959

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone (CID 114119064) is 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone is COC1CC(NCC(=O)N2CCOCC2)C1(C)C.
What is the InChIKey of 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone?
The InChIKey is AIXCXTNLHNQXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-13(2)10(8-11(13)17-3)14-9-12(16)15-4-6-18-7-5-15/h10-11,14H,4-9H2,1-3H3.
What are the key properties of 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone?
2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone has a molecular weight of 256.35 g/mol, XLogP of 0.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 114119064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).