2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone

C10H17N5O2 — CID 66215849

IUPAC2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone
SMILESCNCc1cn(CC(=O)N2CCOCC2)nn1
InChIInChI=1S/C10H17N5O2/c1-11-6-9-7-15(13-12-9)8-10(16)14-2-4-17-5-3-14/h7,11H,2-6,8H2,1H3
InChIKeyXQYZRYLTAHFLTR-UHFFFAOYSA-N
MW239.28 g/mol
LogP-1.14
Rot. Bonds4

About 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone

2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone (PubChem CID 66215849) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone
PubChem CID66215849
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone
SMILESCNCc1cn(CC(=O)N2CCOCC2)nn1
InChIInChI=1S/C10H17N5O2/c1-11-6-9-7-15(13-12-9)8-10(16)14-2-4-17-5-3-14/h7,11H,2-6,8H2,1H3
InChIKeyXQYZRYLTAHFLTR-UHFFFAOYSA-N
XLogP-1.14
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-1.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone 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

2-[4-(2-hydroxyethyl)triazol-1-yl]-1-morpholin-4-ylethanone
CID 62399432
1-(azocan-1-yl)-2-[4-[(propan-2-ylamino)methyl]triazol-1-yl]ethanone
CID 66192997
2-cyano-N-[[1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]triazol-4-yl]methyl]acetamide
CID 155964363
2-[4-[(tert-butylamino)methyl]triazol-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
CID 66191870
1-(2,6-dimethylmorpholin-4-yl)-2-[4-(ethylaminomethyl)triazol-1-yl]ethanone
CID 66193325
2-[4-[(2-methoxyethylamino)methyl]triazol-1-yl]-1-piperidin-1-ylethanone
CID 66206840
1-(3-methylpiperidin-1-yl)-2-[4-[(2-methylpropylamino)methyl]triazol-1-yl]ethanone
CID 66192663
N-methyl-1-[1-(2-pyrrolidin-1-ylethyl)triazol-4-yl]methanamine
CID 62438466
N-(1,3-benzodioxol-5-yl)-2-[4-(methylaminomethyl)triazol-1-yl]acetamide
CID 66214852
3-[(1-tert-butyltriazol-4-yl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 103399375
1-(4-acetylpiperazin-1-yl)-2-[4-(3-aminopropyl)triazol-1-yl]ethanone
CID 106221205
2-[4-(methylaminomethyl)triazol-1-yl]-N-(2-methylbutan-2-yl)acetamide
CID 66193662

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone (CID 66215849) is 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone is CNCc1cn(CC(=O)N2CCOCC2)nn1.
What is the InChIKey of 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is XQYZRYLTAHFLTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-11-6-9-7-15(13-12-9)8-10(16)14-2-4-17-5-3-14/h7,11H,2-6,8H2,1H3.
What are the key properties of 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone?
2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 239.28 g/mol, XLogP of -1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylaminomethyl)triazol-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 66215849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).