(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone

C16H21N5O3 — CID 71830488

IUPAC(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone
SMILESCC1CN(C(=O)c2cccc(OCc3nnnn3C)c2)CC(C)O1
InChIInChI=1S/C16H21N5O3/c1-11-8-21(9-12(2)24-11)16(22)13-5-4-6-14(7-13)23-10-15-17-18-19-20(15)3/h4-7,11-12H,8-10H2,1-3H3
InChIKeyOKVZNKCMNITDRW-UHFFFAOYSA-N
MW331.38 g/mol
LogP1.04
Rot. Bonds4

About (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone

(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone (PubChem CID 71830488) has the molecular formula C16H21N5O3 and a molecular weight of 331.38 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone
PubChem CID71830488
Molecular FormulaC16H21N5O3
Molecular Weight331.38 g/mol
Exact Mass331.16
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone
SMILESCC1CN(C(=O)c2cccc(OCc3nnnn3C)c2)CC(C)O1
InChIInChI=1S/C16H21N5O3/c1-11-8-21(9-12(2)24-11)16(22)13-5-4-6-14(7-13)23-10-15-17-18-19-20(15)3/h4-7,11-12H,8-10H2,1-3H3
InChIKeyOKVZNKCMNITDRW-UHFFFAOYSA-N
XLogP1.04
TPSA82.37 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone with MolForge

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Related Compounds

[3-[(3,4-dichlorophenyl)methoxy]phenyl]-[(2R,6R)-2,6-dimethylmorpholin-4-yl]methanone
CID 8815293
(2,6-dimethylmorpholin-4-yl)-(3-prop-2-enoxyphenyl)methanone
CID 2993576
(2,6-dimethylmorpholin-4-yl)-(3-pyridin-2-yloxyphenyl)methanone
CID 90596689
(4-methylpiperidin-1-yl)-[4-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone
CID 71830519
[4-[(1-methyltetrazol-5-yl)methoxy]phenyl]-morpholin-4-ylmethanone
CID 71830536
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(3-propoxyphenyl)methanone
CID 102938425
1-(2,6-dimethylmorpholin-4-yl)-2-(1-methyltetrazol-5-yl)ethanone
CID 110498375
2-[3-[2-methyl-6-(trifluoromethyl)morpholine-4-carbonyl]phenoxy]acetic acid
CID 138032586
[2-(bromomethyl)-6-methylmorpholin-4-yl]-(3-methoxyphenyl)methanone
CID 102937854
3-[(1-methyltetrazol-5-yl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 91946133
(6R)-6-methyl-4-[3-[(6-methyl-3-pyridinyl)oxymethyl]benzoyl]morpholine-2-carboxylic acid
CID 120536231
1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-[4-[(3-methylphenoxy)methyl]triazol-1-yl]ethanone
CID 100830210

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone (CID 71830488) is (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone is CC1CN(C(=O)c2cccc(OCc3nnnn3C)c2)CC(C)O1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone?
The InChIKey is OKVZNKCMNITDRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O3/c1-11-8-21(9-12(2)24-11)16(22)13-5-4-6-14(7-13)23-10-15-17-18-19-20(15)3/h4-7,11-12H,8-10H2,1-3H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone?
(2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone has a molecular weight of 331.38 g/mol, XLogP of 1.04, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-[3-[(1-methyltetrazol-5-yl)methoxy]phenyl]methanone is sourced from PubChem (CID 71830488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).