2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol

C11H20N4O2 — CID 114686567

IUPAC2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol
SMILESCn1nncc1C(O)C(C)(C)N1CCOCC1
InChIInChI=1S/C11H20N4O2/c1-11(2,15-4-6-17-7-5-15)10(16)9-8-12-13-14(9)3/h8,10,16H,4-7H2,1-3H3
InChIKeyOGVHJRDQHAMXLJ-UHFFFAOYSA-N
MW240.31 g/mol
LogP-0.04
Rot. Bonds3

About 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol

2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol (PubChem CID 114686567) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol.

Molecular Properties

Compound Name2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol
PubChem CID114686567
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol
SMILESCn1nncc1C(O)C(C)(C)N1CCOCC1
InChIInChI=1S/C11H20N4O2/c1-11(2,15-4-6-17-7-5-15)10(16)9-8-12-13-14(9)3/h8,10,16H,4-7H2,1-3H3
InChIKeyOGVHJRDQHAMXLJ-UHFFFAOYSA-N
XLogP-0.04
TPSA63.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2,3-dimethylimidazol-4-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 114283386
1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 79045813
2-methyl-1-(3-phenyltriazol-4-yl)-2-pyrrolidin-1-ylpropan-1-ol
CID 114686563
2-ethoxy-2-methyl-1-(3-methyltriazol-4-yl)propan-1-ol
CID 114686807
2-ethoxy-2-methyl-1-(3-methyltriazol-4-yl)butan-1-ol
CID 114686813
2-methyl-N-[(3-methyltriazol-4-yl)methyl]-2-morpholin-4-ylpropan-1-amine
CID 115682116
1-(1-benzothiophen-7-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 81153067
1-(2-fluoro-3-methoxyphenyl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 82807900
1-(4-bromo-3-chloro-2-fluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 106762078
1-(5-fluoro-2-methoxyphenyl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 82768722
1-(4-bromo-1-methylpyrazol-5-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 114656691
4-methyl-4-morpholin-4-yl-1-phenylpentan-3-ol
CID 79045884

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol?
The IUPAC name of 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol (CID 114686567) is 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol.
What is the SMILES notation for 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol?
The canonical SMILES for 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol is Cn1nncc1C(O)C(C)(C)N1CCOCC1.
What is the InChIKey of 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol?
The InChIKey is OGVHJRDQHAMXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-11(2,15-4-6-17-7-5-15)10(16)9-8-12-13-14(9)3/h8,10,16H,4-7H2,1-3H3.
What are the key properties of 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol?
2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol has a molecular weight of 240.31 g/mol, XLogP of -0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-methyltriazol-4-yl)-2-morpholin-4-ylpropan-1-ol is sourced from PubChem (CID 114686567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).