(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone

C9H14N4O2 — CID 130625566

IUPAC(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone
SMILESCC1OCCNC1C(=O)c1cnn(C)n1
InChIInChI=1S/C9H14N4O2/c1-6-8(10-3-4-15-6)9(14)7-5-11-13(2)12-7/h5-6,8,10H,3-4H2,1-2H3
InChIKeyZZRZVMTXCXYENH-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.63
Rot. Bonds2

About (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone

(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone (PubChem CID 130625566) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone.

Molecular Properties

Compound Name(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone
PubChem CID130625566
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone
SMILESCC1OCCNC1C(=O)c1cnn(C)n1
InChIInChI=1S/C9H14N4O2/c1-6-8(10-3-4-15-6)9(14)7-5-11-13(2)12-7/h5-6,8,10H,3-4H2,1-2H3
InChIKeyZZRZVMTXCXYENH-UHFFFAOYSA-N
XLogP-0.63
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2-methyltriazol-4-yl)-pyrrolidin-2-ylmethanone
CID 130603335
(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide
CID 120942299
(2-methyltriazol-4-yl)-(oxolan-3-yl)methanone
CID 130521398
(2-methyltriazol-4-yl)-pyrrolidin-3-ylmethanone
CID 130603381
[(2R,3S)-2-methylmorpholin-3-yl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 120939440
1-[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperazin-1-yl]ethanone
CID 120916623
4-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperazin-2-one
CID 120918415
(3-methyl-1,4-dithian-2-yl)-(2-methyltriazol-4-yl)methanone
CID 130602494
[3-(1H-imidazol-2-yl)piperidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120939716
(2R,3S)-N,2-dimethyl-N-(2-pyrazol-1-ylethyl)morpholine-3-carboxamide
CID 120941752
(2R,3S)-2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)morpholine-3-carboxamide
CID 120937598
(2R,3S)-2-methyl-N-pyridin-3-ylmorpholine-3-carboxamide
CID 120937694

Frequently Asked Questions

What is the IUPAC name of (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone?
The IUPAC name of (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone (CID 130625566) is (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone.
What is the SMILES notation for (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone?
The canonical SMILES for (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone is CC1OCCNC1C(=O)c1cnn(C)n1.
What is the InChIKey of (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone?
The InChIKey is ZZRZVMTXCXYENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-6-8(10-3-4-15-6)9(14)7-5-11-13(2)12-7/h5-6,8,10H,3-4H2,1-2H3.
What are the key properties of (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone?
(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone has a molecular weight of 210.24 g/mol, XLogP of -0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone is sourced from PubChem (CID 130625566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).