N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C19H20N4O — CID 31844923

IUPACN-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)N(Cc3ccccc3)C3CC3)c2n1
InChIInChI=1S/C19H20N4O/c1-13-10-14(2)23-18(21-13)17(11-20-23)19(24)22(16-8-9-16)12-15-6-4-3-5-7-15/h3-7,10-11,16H,8-9,12H2,1-2H3
InChIKeyRGHBTLPHXVAAEH-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.15
Rot. Bonds4

About N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 31844923) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID31844923
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC NameN-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)N(Cc3ccccc3)C3CC3)c2n1
InChIInChI=1S/C19H20N4O/c1-13-10-14(2)23-18(21-13)17(11-20-23)19(24)22(16-8-9-16)12-15-6-4-3-5-7-15/h3-7,10-11,16H,8-9,12H2,1-2H3
InChIKeyRGHBTLPHXVAAEH-UHFFFAOYSA-N
XLogP3.15
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 31844923) is N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(C)n2ncc(C(=O)N(Cc3ccccc3)C3CC3)c2n1.
What is the InChIKey of N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is RGHBTLPHXVAAEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13-10-14(2)23-18(21-13)17(11-20-23)19(24)22(16-8-9-16)12-15-6-4-3-5-7-15/h3-7,10-11,16H,8-9,12H2,1-2H3.
What are the key properties of N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 31844923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).