6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

C20H29N5O2 — CID 51498751

IUPAC6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCC(=O)c1cnc2cc(C(=O)NC(C)(C)CN3CCC[C@@H](C)C3)nn2c1C
InChIInChI=1S/C20H29N5O2/c1-13-7-6-8-24(11-13)12-20(4,5)22-19(27)17-9-18-21-10-16(15(3)26)14(2)25(18)23-17/h9-10,13H,6-8,11-12H2,1-5H3,(H,22,27)/t13-/m1/s1
InChIKeyXISQOETWQYWZMP-CYBMUJFWSA-N
MW371.49 g/mol
LogP2.48
Rot. Bonds5

About 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 51498751) has the molecular formula C20H29N5O2 and a molecular weight of 371.49 g/mol. Its IUPAC name is 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID51498751
Molecular FormulaC20H29N5O2
Molecular Weight371.49 g/mol
Exact Mass371.23
IUPAC Name6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCC(=O)c1cnc2cc(C(=O)NC(C)(C)CN3CCC[C@@H](C)C3)nn2c1C
InChIInChI=1S/C20H29N5O2/c1-13-7-6-8-24(11-13)12-20(4,5)22-19(27)17-9-18-21-10-16(15(3)26)14(2)25(18)23-17/h9-10,13H,6-8,11-12H2,1-5H3,(H,22,27)/t13-/m1/s1
InChIKeyXISQOETWQYWZMP-CYBMUJFWSA-N
XLogP2.48
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.49
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

5-cyclopropyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]-1,2-oxazole-3-carboxamide
CID 92584063
N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]-5-propyl-1H-pyrazole-3-carboxamide
CID 51871995
N-[2-methyl-1-(3-methylpiperidin-1-yl)propan-2-yl]-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 46954616
5-hydroxy-2-methyl-N-[2-methyl-1-(3-methylpiperidin-1-yl)propan-2-yl]-1-benzofuran-3-carboxamide
CID 46964352
7-(4-methoxyphenyl)-N-(2-methyl-1-piperidin-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 46951607
N-cyclohexyl-7-methyl-2-phenylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 811833
(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-(2,3-dimethylpyrrolidin-1-yl)methanone
CID 127432946
2-cyclopropyl-2-[(2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carbonyl)amino]acetic acid
CID 62696101
4-chloro-N-(2-methylbutan-2-yl)-3-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzamide
CID 40820715
2,7-dimethyl-N-propan-2-ylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 60714222
2-ethyl-2-[(3-methylpiperidin-1-yl)methyl]butanoic acid
CID 62271358
N-tert-butyl-2-(3-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109311314

Frequently Asked Questions

What is the IUPAC name of 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 51498751) is 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is CC(=O)c1cnc2cc(C(=O)NC(C)(C)CN3CCC[C@@H](C)C3)nn2c1C.
What is the InChIKey of 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is XISQOETWQYWZMP-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H29N5O2/c1-13-7-6-8-24(11-13)12-20(4,5)22-19(27)17-9-18-21-10-16(15(3)26)14(2)25(18)23-17/h9-10,13H,6-8,11-12H2,1-5H3,(H,22,27)/t13-/m1/s1.
What are the key properties of 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 371.49 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-7-methyl-N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 51498751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).