(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine

C14H21N5O — CID 56899248

IUPAC(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine
SMILESCCc1nc(N2C[C@@H](C)O[C@@H](C)C2)c2cnn(C)c2n1
InChIInChI=1S/C14H21N5O/c1-5-12-16-13-11(6-15-18(13)4)14(17-12)19-7-9(2)20-10(3)8-19/h6,9-10H,5,7-8H2,1-4H3/t9-,10+
InChIKeyULLKKTGLZHBHDT-AOOOYVTPSA-N
MW275.36 g/mol
LogP1.54
Rot. Bonds2

About (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine

(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine (PubChem CID 56899248) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine
PubChem CID56899248
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine
SMILESCCc1nc(N2C[C@@H](C)O[C@@H](C)C2)c2cnn(C)c2n1
InChIInChI=1S/C14H21N5O/c1-5-12-16-13-11(6-15-18(13)4)14(17-12)19-7-9(2)20-10(3)8-19/h6,9-10H,5,7-8H2,1-4H3/t9-,10+
InChIKeyULLKKTGLZHBHDT-AOOOYVTPSA-N
XLogP1.54
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,6S)-2,6-dimethyl-4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
CID 7197181
(2R,6S)-2,6-dimethyl-4-[1-methyl-6-(3-methylpyrrolidin-1-yl)pyrazolo[5,4-d]pyrimidin-4-yl]morpholine
CID 166397967
4-[(4-chloro-1-methylpyrazolo[5,4-d]pyrimidin-6-yl)methyl]-2,6-dimethylmorpholine
CID 63220281
2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
CID 8547617
1-(6-cyclopentyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)azetidin-3-amine
CID 56909758
(2S,6R)-4-(6-chloro-2-ethylpyrimidin-4-yl)-2,6-dimethylmorpholine
CID 104959793
6-(2,6-dimethylmorpholin-4-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
CID 80982249
[(3S)-1-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)piperidin-3-yl]-pyridin-2-ylmethanone
CID 95711494
(2S,6S)-2,6-dimethyl-4-(6-methyl-1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
CID 2380610
2-[(3S)-1-(1-methyl-6-propylpyrazolo[5,4-d]pyrimidin-4-yl)piperidin-3-yl]ethanamine
CID 95718016
(2S,6R)-4-(2-chloro-6-ethylthieno[2,3-d]pyrimidin-4-yl)-2,6-dimethylmorpholine
CID 93213873
N-ethyl-1-methyl-4-pyrrolidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine
CID 50795389

Frequently Asked Questions

What is the IUPAC name of (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine?
The IUPAC name of (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine (CID 56899248) is (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine.
What is the SMILES notation for (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine?
The canonical SMILES for (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine is CCc1nc(N2C[C@@H](C)O[C@@H](C)C2)c2cnn(C)c2n1.
What is the InChIKey of (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine?
The InChIKey is ULLKKTGLZHBHDT-AOOOYVTPSA-N. The full InChI is InChI=1S/C14H21N5O/c1-5-12-16-13-11(6-15-18(13)4)14(17-12)19-7-9(2)20-10(3)8-19/h6,9-10H,5,7-8H2,1-4H3/t9-,10+.
What are the key properties of (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine?
(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine has a molecular weight of 275.36 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine is sourced from PubChem (CID 56899248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).