2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide

C19H21N5O2 — CID 131942924

IUPAC2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCNC(=O)CCc1ccccc1NC(=O)c1cc(C)n2nc(C)cc2n1
InChIInChI=1S/C19H21N5O2/c1-12-10-17-21-16(11-13(2)24(17)23-12)19(26)22-15-7-5-4-6-14(15)8-9-18(25)20-3/h4-7,10-11H,8-9H2,1-3H3,(H,20,25)(H,22,26)
InChIKeyZFKVARADUQBIMU-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.28
Rot. Bonds5

About 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide

2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 131942924) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID131942924
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCNC(=O)CCc1ccccc1NC(=O)c1cc(C)n2nc(C)cc2n1
InChIInChI=1S/C19H21N5O2/c1-12-10-17-21-16(11-13(2)24(17)23-12)19(26)22-15-7-5-4-6-14(15)8-9-18(25)20-3/h4-7,10-11H,8-9H2,1-3H3,(H,20,25)(H,22,26)
InChIKeyZFKVARADUQBIMU-UHFFFAOYSA-N
XLogP2.28
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,7-dimethyl-N-quinolin-8-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110863548
N-(2,6-dimethylphenyl)-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110857591
N-[2-[3-(methylamino)-3-oxopropyl]phenyl]-2-(1,2,4-triazol-4-yl)benzamide
CID 131908970
N-[2-(4-chlorophenyl)ethyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110853496
2,7-dimethyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110851998
methyl 3-[(2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carbonyl)amino]benzoate
CID 53041004
N-(1,3-benzodioxol-5-yl)-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110863263
3-methyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]furan-2-carboxamide
CID 131924655
N-(3-chloro-4-fluorophenyl)-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040999
N-(2-hydroxyphenyl)-3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanamide
CID 31617297
N-methyl-3-[2-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]phenyl]propanamide
CID 131922657
N-naphthalen-1-yl-3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanamide
CID 33142251

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 131942924) is 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide is CNC(=O)CCc1ccccc1NC(=O)c1cc(C)n2nc(C)cc2n1.
What is the InChIKey of 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is ZFKVARADUQBIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-12-10-17-21-16(11-13(2)24(17)23-12)19(26)22-15-7-5-4-6-14(15)8-9-18(25)20-3/h4-7,10-11H,8-9H2,1-3H3,(H,20,25)(H,22,26).
What are the key properties of 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide?
2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-N-[2-[3-(methylamino)-3-oxopropyl]phenyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 131942924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).