4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one

C11H22N2O3 — CID 115475838

IUPAC4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one
SMILESCC(C)CNCC(O)CN1CCOCC1=O
InChIInChI=1S/C11H22N2O3/c1-9(2)5-12-6-10(14)7-13-3-4-16-8-11(13)15/h9-10,12,14H,3-8H2,1-2H3
InChIKeyNXNRDMXZFHCQLX-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.55
Rot. Bonds6

About 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one

4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one (PubChem CID 115475838) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one.

Molecular Properties

Compound Name4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one
PubChem CID115475838
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one
SMILESCC(C)CNCC(O)CN1CCOCC1=O
InChIInChI=1S/C11H22N2O3/c1-9(2)5-12-6-10(14)7-13-3-4-16-8-11(13)15/h9-10,12,14H,3-8H2,1-2H3
InChIKeyNXNRDMXZFHCQLX-UHFFFAOYSA-N
XLogP-0.55
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(Aminomethyl)-4-methyl-3-morpholinone
CID 24262147
2-[2-hydroxyethyl(methyl)amino]-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]acetamide
CID 72063557
4-ethyl-N-(2-methoxyethyl)morpholine-2-carboxamide
CID 72121023
N-[[4-(cyclopropylmethyl)morpholin-2-yl]methyl]acetamide
CID 75382049
1,1-diethyl-3-[[(2S)-4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl]urea
CID 164639220
2-Hydroxy-N-(3-(4-morpholinyl)propyl)acetamide
CID 3026118
N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61739679
1-[2-(Methylaminomethyl)morpholin-4-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 103209686
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)morpholine-2-carboxamide
CID 107479279
2-fluoro-N-(2-hydroxy-3-morpholin-4-ylpropyl)-2-methylpropanamide
CID 109927810
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 111112800
N-methyl-N-(morpholin-2-ylmethyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 113788479

Frequently Asked Questions

What is the IUPAC name of 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one?
The IUPAC name of 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one (CID 115475838) is 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one.
What is the SMILES notation for 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one?
The canonical SMILES for 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one is CC(C)CNCC(O)CN1CCOCC1=O.
What is the InChIKey of 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one?
The InChIKey is NXNRDMXZFHCQLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-9(2)5-12-6-10(14)7-13-3-4-16-8-11(13)15/h9-10,12,14H,3-8H2,1-2H3.
What are the key properties of 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one?
4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one has a molecular weight of 230.31 g/mol, XLogP of -0.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-hydroxy-3-(2-methylpropylamino)propyl]morpholin-3-one is sourced from PubChem (CID 115475838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).