(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone

C14H16N8O2 — CID 157014027

IUPAC(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone
SMILESCc1cnc2c(C(=O)N3CCOC(c4nnn(C)n4)C3)cnn2c1
InChIInChI=1S/C14H16N8O2/c1-9-5-15-13-10(6-16-22(13)7-9)14(23)21-3-4-24-11(8-21)12-17-19-20(2)18-12/h5-7,11H,3-4,8H2,1-2H3
InChIKeyYZNHPOCSAFQRJS-UHFFFAOYSA-N
MW328.34 g/mol
LogP-0.23
Rot. Bonds2

About (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone

(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone (PubChem CID 157014027) has the molecular formula C14H16N8O2 and a molecular weight of 328.34 g/mol. Its IUPAC name is (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone
PubChem CID157014027
Molecular FormulaC14H16N8O2
Molecular Weight328.34 g/mol
Exact Mass328.14
IUPAC Name(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone
SMILESCc1cnc2c(C(=O)N3CCOC(c4nnn(C)n4)C3)cnn2c1
InChIInChI=1S/C14H16N8O2/c1-9-5-15-13-10(6-16-22(13)7-9)14(23)21-3-4-24-11(8-21)12-17-19-20(2)18-12/h5-7,11H,3-4,8H2,1-2H3
InChIKeyYZNHPOCSAFQRJS-UHFFFAOYSA-N
XLogP-0.23
TPSA103.33 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

(1-methylimidazol-2-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone
CID 157014614
[(2S)-2-[6-[(3-chlorophenyl)methyl]-2-pyridinyl]morpholin-4-yl]-(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
CID 124967747
imidazo[2,1-b][1,3]thiazol-6-yl-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone
CID 157013598
(3aR,6aR)-2-methyl-5-(6-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)-3,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole-3a-carboxylic acid
CID 133133153
(1,3-dimethylpyrazol-4-yl)-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]methanone
CID 124990802
(2R)-N-cyclopentyl-2-methyl-4-(6-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)morpholine-2-carboxamide
CID 92632661
3-ethoxy-1-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]propan-1-one
CID 157020129
N,N-dimethyl-2-[1-(6-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-4-yl]acetamide
CID 92633808
N-methyl-2-[1-(6-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-4-yl]acetamide
CID 92633814
(1,3-dimethylpyrazol-4-yl)-[(2S)-2-(5-ethyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]methanone
CID 96996940
(4-methylpyrazolo[1,5-a]pyridin-3-yl)-(2-pyridin-2-ylmorpholin-4-yl)methanone
CID 137345147
(4-methoxy-3-morpholin-4-ylphenyl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone
CID 157015275

Frequently Asked Questions

What is the IUPAC name of (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone?
The IUPAC name of (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone (CID 157014027) is (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone?
The canonical SMILES for (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone is Cc1cnc2c(C(=O)N3CCOC(c4nnn(C)n4)C3)cnn2c1.
What is the InChIKey of (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone?
The InChIKey is YZNHPOCSAFQRJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N8O2/c1-9-5-15-13-10(6-16-22(13)7-9)14(23)21-3-4-24-11(8-21)12-17-19-20(2)18-12/h5-7,11H,3-4,8H2,1-2H3.
What are the key properties of (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone?
(6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone has a molecular weight of 328.34 g/mol, XLogP of -0.23, 2 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(2-methyltetrazol-5-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 157014027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).