[1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone

C18H23N5O3 — CID 87045046

IUPAC[1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
SMILESCc1nn2cccnc2c1C(=O)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C18H23N5O3/c1-13-15(16-19-5-3-7-23(16)20-13)18(25)22-6-2-4-14(12-22)17(24)21-8-10-26-11-9-21/h3,5,7,14H,2,4,6,8-12H2,1H3
InChIKeyCICWGWBWBMSFAH-UHFFFAOYSA-N
MW357.41 g/mol
LogP0.75
Rot. Bonds2

About [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone

[1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone (PubChem CID 87045046) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
PubChem CID87045046
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name[1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
SMILESCc1nn2cccnc2c1C(=O)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C18H23N5O3/c1-13-15(16-19-5-3-7-23(16)20-13)18(25)22-6-2-4-14(12-22)17(24)21-8-10-26-11-9-21/h3,5,7,14H,2,4,6,8-12H2,1H3
InChIKeyCICWGWBWBMSFAH-UHFFFAOYSA-N
XLogP0.75
TPSA80.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone 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

1-[(5,7-Dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester
CID 3244226
US11142526, Example 171
CID 137533144
5,7-dimethyl-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 45809737
(2-Methylpyrazolo[1,5-a]pyrimidin-3-yl)-(3-pyrazol-1-ylpiperidin-1-yl)methanone
CID 72045334
[3-(3,5-Dimethyl-1,2,4-triazol-1-yl)piperidin-1-yl]-(2-methylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
CID 72142736
[3-(5-Methyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-(2-methylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
CID 72147270
7-[1-(2-Methoxyethyl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 118739933
(2-Methylpyrazolo[1,5-a]pyrimidin-6-yl)-morpholin-4-ylmethanone
CID 134793369
2-methyl-N-(2-morpholin-4-ylethyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 134794555
(2-Methylpyrazolo[1,5-a]pyrimidin-6-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 134794784
(2-Methylpyrazolo[1,5-a]pyrimidin-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 134794921
1-[4-(2-Methylpyrazolo[1,5-a]pyrimidine-6-carbonyl)piperazin-1-yl]ethanone
CID 134795060

Frequently Asked Questions

What is the IUPAC name of [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone (CID 87045046) is [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone is Cc1nn2cccnc2c1C(=O)N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is CICWGWBWBMSFAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O3/c1-13-15(16-19-5-3-7-23(16)20-13)18(25)22-6-2-4-14(12-22)17(24)21-8-10-26-11-9-21/h3,5,7,14H,2,4,6,8-12H2,1H3.
What are the key properties of [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone?
[1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 357.41 g/mol, XLogP of 0.75, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 87045046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).