1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol

C12H24N2O2 — CID 71859849

IUPAC1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESC=C(C)CN(C)CC(O)CN1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-11(2)8-13(3)9-12(15)10-14-4-6-16-7-5-14/h12,15H,1,4-10H2,2-3H3
InChIKeyHCQMGMKKWXLVKO-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.19
Rot. Bonds6

About 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol

1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 71859849) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol
PubChem CID71859849
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESC=C(C)CN(C)CC(O)CN1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-11(2)8-13(3)9-12(15)10-14-4-6-16-7-5-14/h12,15H,1,4-10H2,2-3H3
InChIKeyHCQMGMKKWXLVKO-UHFFFAOYSA-N
XLogP0.19
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[methyl(propyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 110909710
1-[3,3-dimethylbutyl(methyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 111916497
1-[methyl(pentyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 111916407
1-[methyl(3,3,3-trifluoropropyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 110905333
1-(2-methylprop-2-enylamino)-3-morpholin-4-ylpropan-2-ol
CID 115574800
1-[cyclopentyl(methyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 110882289
1-[[2-(4-fluorophenyl)-2-hydroxyethyl]-methylamino]-3-morpholin-4-ylpropan-2-ol
CID 111423789
1-[(2,6-dimethylphenyl)methyl-methylamino]-3-morpholin-4-ylpropan-2-ol
CID 111916464
3-methyl-1-morpholin-4-ylbut-3-en-2-ol
CID 13415301
potassium N-[2-hydroxy-3-[(2-hydroxy-3-morpholin-4-ylpropyl)-methylamino]propyl]sulfamate
CID 131888727
1-[[2-(dimethylamino)phenyl]methyl-methylamino]-3-morpholin-4-ylpropan-2-ol
CID 111916375
1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-2-ol
CID 129310449

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol (CID 71859849) is 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol is C=C(C)CN(C)CC(O)CN1CCOCC1.
What is the InChIKey of 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is HCQMGMKKWXLVKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-11(2)8-13(3)9-12(15)10-14-4-6-16-7-5-14/h12,15H,1,4-10H2,2-3H3.
What are the key properties of 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol?
1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 228.34 g/mol, XLogP of 0.19, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(2-methylprop-2-enyl)amino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 71859849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).