N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C12H15N5O — CID 118740117

IUPACN-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2c(C3CCCN3)ccnc12
InChIInChI=1S/C12H15N5O/c1-13-12(18)8-7-16-17-10(4-6-15-11(8)17)9-3-2-5-14-9/h4,6-7,9,14H,2-3,5H2,1H3,(H,13,18)
InChIKeyRHVPSFNVEKNILE-UHFFFAOYSA-N
MW245.29 g/mol
LogP0.51
Rot. Bonds2

About N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 118740117) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID118740117
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC NameN-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2c(C3CCCN3)ccnc12
InChIInChI=1S/C12H15N5O/c1-13-12(18)8-7-16-17-10(4-6-15-11(8)17)9-3-2-5-14-9/h4,6-7,9,14H,2-3,5H2,1H3,(H,13,18)
InChIKeyRHVPSFNVEKNILE-UHFFFAOYSA-N
XLogP0.51
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 118740117) is N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CNC(=O)c1cnn2c(C3CCCN3)ccnc12.
What is the InChIKey of N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is RHVPSFNVEKNILE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-13-12(18)8-7-16-17-10(4-6-15-11(8)17)9-3-2-5-14-9/h4,6-7,9,14H,2-3,5H2,1H3,(H,13,18).
What are the key properties of N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 245.29 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7-pyrrolidin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 118740117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).