3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione

C15H23N7O4 — CID 91836283

IUPAC3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione
SMILESCOCCn1nnnc1C1CN(CCn2c(=O)cc(C)[nH]c2=O)CCO1
InChIInChI=1S/C15H23N7O4/c1-11-9-13(23)21(15(24)16-11)4-3-20-5-8-26-12(10-20)14-17-18-19-22(14)6-7-25-2/h9,12H,3-8,10H2,1-2H3,(H,16,24)
InChIKeySBLWLQFRCLVRNL-UHFFFAOYSA-N
MW365.39 g/mol
LogP-1.45
Rot. Bonds7

About 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione

3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione (PubChem CID 91836283) has the molecular formula C15H23N7O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione
PubChem CID91836283
Molecular FormulaC15H23N7O4
Molecular Weight365.39 g/mol
Exact Mass365.18
IUPAC Name3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione
SMILESCOCCn1nnnc1C1CN(CCn2c(=O)cc(C)[nH]c2=O)CCO1
InChIInChI=1S/C15H23N7O4/c1-11-9-13(23)21(15(24)16-11)4-3-20-5-8-26-12(10-20)14-17-18-19-22(14)6-7-25-2/h9,12H,3-8,10H2,1-2H3,(H,16,24)
InChIKeySBLWLQFRCLVRNL-UHFFFAOYSA-N
XLogP-1.45
TPSA120.16 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 5-1.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

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Related Compounds

(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]-4-[2-(3-methylpyrazol-1-yl)ethyl]morpholine
CID 124755660
(2R)-4-(1H-benzimidazol-2-ylmethyl)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholine
CID 99926108
N-(4-fluorophenyl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]acetamide
CID 124756422
(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
(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]-4-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]morpholine
CID 99926144
1-(2,3-dihydroindol-1-yl)-2-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethanone
CID 124754682
3-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]propan-1-one
CID 124750662
6-methyl-3-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 91836009
1-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]-2-pyridin-3-ylethanone
CID 118778786
(2,7-dimethylpyrazolo[1,5-a]pyrimidin-5-yl)-[(2S)-2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methanone
CID 99933795
2-(2,4-dimethyl-1,3-thiazol-5-yl)-1-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethanone
CID 74243081

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione?
The IUPAC name of 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione (CID 91836283) is 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione is COCCn1nnnc1C1CN(CCn2c(=O)cc(C)[nH]c2=O)CCO1.
What is the InChIKey of 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione?
The InChIKey is SBLWLQFRCLVRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N7O4/c1-11-9-13(23)21(15(24)16-11)4-3-20-5-8-26-12(10-20)14-17-18-19-22(14)6-7-25-2/h9,12H,3-8,10H2,1-2H3,(H,16,24).
What are the key properties of 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione?
3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione has a molecular weight of 365.39 g/mol, XLogP of -1.45, 7 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-[1-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 91836283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).