N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide

C16H21FN6O3 — CID 124756422

IUPACN-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide
SMILESCOCCn1nnnc1[C@H]1CN(CC(=O)Nc2ccc(F)cc2)CCO1
InChIInChI=1S/C16H21FN6O3/c1-25-8-7-23-16(19-20-21-23)14-10-22(6-9-26-14)11-15(24)18-13-4-2-12(17)3-5-13/h2-5,14H,6-11H2,1H3,(H,18,24)/t14-/m1/s1
InChIKeySPZBDZMBRXYSRG-CQSZACIVSA-N
MW364.38 g/mol
LogP0.47
Rot. Bonds7

About N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide

N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide (PubChem CID 124756422) has the molecular formula C16H21FN6O3 and a molecular weight of 364.38 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide
PubChem CID124756422
Molecular FormulaC16H21FN6O3
Molecular Weight364.38 g/mol
Exact Mass364.17
IUPAC NameN-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide
SMILESCOCCn1nnnc1[C@H]1CN(CC(=O)Nc2ccc(F)cc2)CCO1
InChIInChI=1S/C16H21FN6O3/c1-25-8-7-23-16(19-20-21-23)14-10-22(6-9-26-14)11-15(24)18-13-4-2-12(17)3-5-13/h2-5,14H,6-11H2,1H3,(H,18,24)/t14-/m1/s1
InChIKeySPZBDZMBRXYSRG-CQSZACIVSA-N
XLogP0.47
TPSA94.40 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.38
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

1-(2,3-dihydroindol-1-yl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethanone
CID 124754682
4-[[2-[2-(4-fluorophenyl)morpholin-4-yl]acetyl]amino]-N-methylbenzamide
CID 55566264
N-(4-acetylphenyl)-2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetamide
CID 36737265
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 42888495
2-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
CID 36737398
(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]-4-[2-(3-methylpyrazol-1-yl)ethyl]morpholine
CID 124755660
2-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 36874378
(2R)-4-(1H-benzimidazol-2-ylmethyl)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholine
CID 99926108
2-[4-[4-ethyl-1-(2-methoxyethyl)-5-oxo-1,2,4-triazol-3-yl]piperidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 121118174
3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione
CID 91836283
(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]-4-[(4-pyrazol-1-ylphenyl)methyl]morpholine
CID 124841302
2-[1-(2-methoxyethyl)tetrazol-5-yl]-4-[(4-pyrazol-1-ylphenyl)methyl]morpholine
CID 91844335

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide (CID 124756422) is N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide is COCCn1nnnc1[C@H]1CN(CC(=O)Nc2ccc(F)cc2)CCO1.
What is the InChIKey of N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide?
The InChIKey is SPZBDZMBRXYSRG-CQSZACIVSA-N. The full InChI is InChI=1S/C16H21FN6O3/c1-25-8-7-23-16(19-20-21-23)14-10-22(6-9-26-14)11-15(24)18-13-4-2-12(17)3-5-13/h2-5,14H,6-11H2,1H3,(H,18,24)/t14-/m1/s1.
What are the key properties of N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide?
N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide has a molecular weight of 364.38 g/mol, XLogP of 0.47, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide is sourced from PubChem (CID 124756422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).