N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide

C17H18N4O — CID 19898797

IUPACN,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide
SMILESCc1ccc(-c2nn3cccnc3c2CC(=O)N(C)C)cc1
InChIInChI=1S/C17H18N4O/c1-12-5-7-13(8-6-12)16-14(11-15(22)20(2)3)17-18-9-4-10-21(17)19-16/h4-10H,11H2,1-3H3
InChIKeyGMHDFZYCYOMDNJ-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.34
Rot. Bonds3

About N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide

N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide (PubChem CID 19898797) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide
PubChem CID19898797
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC NameN,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide
SMILESCc1ccc(-c2nn3cccnc3c2CC(=O)N(C)C)cc1
InChIInChI=1S/C17H18N4O/c1-12-5-7-13(8-6-12)16-14(11-15(22)20(2)3)17-18-9-4-10-21(17)19-16/h4-10H,11H2,1-3H3
InChIKeyGMHDFZYCYOMDNJ-UHFFFAOYSA-N
XLogP2.34
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]-N,N-dipropylacetamide
CID 19898819
2-[2-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetic acid
CID 82272165
2-[3-chloro-5,7,8-trimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-6-yl]-N,N-dimethylacetamide
CID 175520441
[2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanol
CID 82271926
ethyl 2-(6-propan-2-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 165166467
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798
ethyl 2-bromopyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 71742950
N-methoxy-N,2-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 87044923
2-[2-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]ethanamine
CID 82272264
N,N-dimethyl-2-[3-(4-methylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]acetamide
CID 11784017
(2-propan-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanol
CID 82271913
2-(3-ethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 82271897

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide (CID 19898797) is N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide is Cc1ccc(-c2nn3cccnc3c2CC(=O)N(C)C)cc1.
What is the InChIKey of N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide?
The InChIKey is GMHDFZYCYOMDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c1-12-5-7-13(8-6-12)16-14(11-15(22)20(2)3)17-18-9-4-10-21(17)19-16/h4-10H,11H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide?
N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide has a molecular weight of 294.36 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide is sourced from PubChem (CID 19898797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).