1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide

C15H17F2N5O2 — CID 969761

IUPAC1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide
SMILESCc1cc(C(F)F)n2ncc(C(=O)N3CCC(C(N)=O)CC3)c2n1
InChIInChI=1S/C15H17F2N5O2/c1-8-6-11(12(16)17)22-14(20-8)10(7-19-22)15(24)21-4-2-9(3-5-21)13(18)23/h6-7,9,12H,2-5H2,1H3,(H2,18,23)
InChIKeyIGXOTVNZNQOWEC-UHFFFAOYSA-N
MW337.33 g/mol
LogP1.31
Rot. Bonds3

About 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide

1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide (PubChem CID 969761) has the molecular formula C15H17F2N5O2 and a molecular weight of 337.33 g/mol. Its IUPAC name is 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide
PubChem CID969761
Molecular FormulaC15H17F2N5O2
Molecular Weight337.33 g/mol
Exact Mass337.14
IUPAC Name1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide
SMILESCc1cc(C(F)F)n2ncc(C(=O)N3CCC(C(N)=O)CC3)c2n1
InChIInChI=1S/C15H17F2N5O2/c1-8-6-11(12(16)17)22-14(20-8)10(7-19-22)15(24)21-4-2-9(3-5-21)13(18)23/h6-7,9,12H,2-5H2,1H3,(H2,18,23)
InChIKeyIGXOTVNZNQOWEC-UHFFFAOYSA-N
XLogP1.31
TPSA93.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.33
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide 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

[7-(Difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidin-3-yl](piperidin-1-yl)methanone
CID 1093978
N-isobutyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 2821351
N-cycloheptyl-7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 969631
5-cyclopropyl-7-(difluoromethyl)-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1256693
5-Cyclopropyl-7-(difluoromethyl)-3-(4-morpholinylcarbonyl)pyrazolo[1,5-a]pyrimidine
CID 2165688
N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1097821
5,7-Dimethylpyrazolo[1,5-A]pyrimidine-3-carboxamide
CID 17593557
N,5,7-trimethylpyrazolo(1,5-a)pyrimidine-3-carboxamide
CID 19440818
5-Cyclopropyl-7-(difluoromethyl)-3-(1-pyrrolidinylcarbonyl)pyrazolo[1,5-a]pyrimidine
CID 1256831
1-[(5,7-Dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester
CID 3244226
5,7-dimethyl-N-propan-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1097803
5,7-dimethyl-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19440633

Frequently Asked Questions

What is the IUPAC name of 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide?
The IUPAC name of 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide (CID 969761) is 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide is Cc1cc(C(F)F)n2ncc(C(=O)N3CCC(C(N)=O)CC3)c2n1.
What is the InChIKey of 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide?
The InChIKey is IGXOTVNZNQOWEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F2N5O2/c1-8-6-11(12(16)17)22-14(20-8)10(7-19-22)15(24)21-4-2-9(3-5-21)13(18)23/h6-7,9,12H,2-5H2,1H3,(H2,18,23).
What are the key properties of 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide?
1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide has a molecular weight of 337.33 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[7-(difluoromethyl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-4-carboxamide is sourced from PubChem (CID 969761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).