2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone

C12H25N3O3 — CID 106147488

IUPAC2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone
SMILESCN(C)CC(C)(O)CNCC(=O)N1CCOCC1
InChIInChI=1S/C12H25N3O3/c1-12(17,10-14(2)3)9-13-8-11(16)15-4-6-18-7-5-15/h13,17H,4-10H2,1-3H3
InChIKeyGJCRZKCBCXFLIW-UHFFFAOYSA-N
MW259.35 g/mol
LogP-1.25
Rot. Bonds6

About 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone

2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone (PubChem CID 106147488) has the molecular formula C12H25N3O3 and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone
PubChem CID106147488
Molecular FormulaC12H25N3O3
Molecular Weight259.35 g/mol
Exact Mass259.19
IUPAC Name2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone
SMILESCN(C)CC(C)(O)CNCC(=O)N1CCOCC1
InChIInChI=1S/C12H25N3O3/c1-12(17,10-14(2)3)9-13-8-11(16)15-4-6-18-7-5-15/h13,17H,4-10H2,1-3H3
InChIKeyGJCRZKCBCXFLIW-UHFFFAOYSA-N
XLogP-1.25
TPSA65.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone with MolForge

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Related Compounds

2-[(2-hydroxy-2-methylpentyl)amino]-1-morpholin-4-ylethanone
CID 114169442
N-carbamoyl-2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]acetamide
CID 106147492
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylethanone
CID 103746720
2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
CID 47009992
2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-N-propylacetamide
CID 106147606
2-methyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]propanamide
CID 61218287
2-[(1-amino-2-methylpropan-2-yl)-methylamino]-1-morpholin-4-ylethanone
CID 62007959
N-[2-[(2-morpholin-4-yl-2-oxoethyl)amino]ethyl]acetamide
CID 43400877
tert-butyl 4-[[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]methyl]piperidine-1-carboxylate
CID 103838891
N-cyclopropyl-2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-N-ethylacetamide
CID 106147557
2-(methoxyamino)-1-morpholin-4-ylethanone
CID 60702997
2-[methyl(methylaminomethyl)amino]-1-morpholin-4-ylethanone
CID 177179015

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone (CID 106147488) is 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone is CN(C)CC(C)(O)CNCC(=O)N1CCOCC1.
What is the InChIKey of 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone?
The InChIKey is GJCRZKCBCXFLIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3/c1-12(17,10-14(2)3)9-13-8-11(16)15-4-6-18-7-5-15/h13,17H,4-10H2,1-3H3.
What are the key properties of 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone?
2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone has a molecular weight of 259.35 g/mol, XLogP of -1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 106147488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).