(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine

C18H26N4O — CID 169049574

IUPAC(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine
SMILESCc1cc([C@@H]2CNCCO2)n2nc(C3CCC(C)CC3)cc2n1
InChIInChI=1S/C18H26N4O/c1-12-3-5-14(6-4-12)15-10-18-20-13(2)9-16(22(18)21-15)17-11-19-7-8-23-17/h9-10,12,14,17,19H,3-8,11H2,1-2H3/t12?,14?,17-/m0/s1
InChIKeyYYCZBLXUWASSFX-AJUCZRQESA-N
MW314.43 g/mol
LogP2.99
Rot. Bonds2

About (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine

(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine (PubChem CID 169049574) has the molecular formula C18H26N4O and a molecular weight of 314.43 g/mol. Its IUPAC name is (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine.

Molecular Properties

Compound Name(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine
PubChem CID169049574
Molecular FormulaC18H26N4O
Molecular Weight314.43 g/mol
Exact Mass314.21
IUPAC Name(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine
SMILESCc1cc([C@@H]2CNCCO2)n2nc(C3CCC(C)CC3)cc2n1
InChIInChI=1S/C18H26N4O/c1-12-3-5-14(6-4-12)15-10-18-20-13(2)9-16(22(18)21-15)17-11-19-7-8-23-17/h9-10,12,14,17,19H,3-8,11H2,1-2H3/t12?,14?,17-/m0/s1
InChIKeyYYCZBLXUWASSFX-AJUCZRQESA-N
XLogP2.99
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine 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

(2R,5S)-2-[2-(4-tert-butylcyclohexyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-5-methylmorpholine
CID 162723889
7-cyclopropyl-2,5-dimethylpyrazolo[1,5-a]pyrimidine
CID 146491583
trideuteriomethyl (2S)-2-[5-methyl-2-[4-(trifluoromethyl)cyclohexyl]pyrazolo[1,5-a]pyrimidin-7-yl]morpholine-4-carboxylate
CID 169049540
propan-2-yl (2R)-2-[5-methyl-2-[4-(trifluoromethyl)cyclohexyl]pyrazolo[1,5-a]pyrimidin-7-yl]morpholine-4-carboxylate
CID 162724040
5,6-dimethyl-7-[(3S,4S)-4-methylpiperidin-3-yl]-2-[4-(trifluoromethyl)cyclohexyl]pyrazolo[1,5-a]pyrimidine
CID 162724005
2-[3-(3-methylcyclopentyl)imidazol-4-yl]morpholine
CID 114722523
2-(1,5-dimethylpyrazol-3-yl)morpholine
CID 82601049
7-chloro-2-cyclobutyl-5-methylpyrazolo[1,5-a]pyrimidine
CID 82269835
7-chloro-2-cyclopentyl-5-methylpyrazolo[1,5-a]pyrimidine
CID 82269836
(5R)-8-[5-methyl-2-(3-methylcyclobutyl)pyrazolo[1,5-a]pyrimidin-7-yl]-3-oxa-8-azabicyclo[3.2.1]octane
CID 129066369
6-ethyl-5-methyl-7-[(3S,4S)-4-methylpiperidin-3-yl]-2-[4-(trifluoromethyl)cyclohexyl]pyrazolo[1,5-a]pyrimidine
CID 169049578
7-chloro-2-cyclopropyl-5,6-dimethylpyrazolo[1,5-a]pyrimidine
CID 82269862

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine?
The IUPAC name of (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine (CID 169049574) is (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine.
What is the SMILES notation for (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine?
The canonical SMILES for (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine is Cc1cc([C@@H]2CNCCO2)n2nc(C3CCC(C)CC3)cc2n1.
What is the InChIKey of (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine?
The InChIKey is YYCZBLXUWASSFX-AJUCZRQESA-N. The full InChI is InChI=1S/C18H26N4O/c1-12-3-5-14(6-4-12)15-10-18-20-13(2)9-16(22(18)21-15)17-11-19-7-8-23-17/h9-10,12,14,17,19H,3-8,11H2,1-2H3/t12?,14?,17-/m0/s1.
What are the key properties of (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine?
(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine has a molecular weight of 314.43 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine is sourced from PubChem (CID 169049574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).