6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H23N5O2 — CID 56758821

IUPAC6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCN(CC)Cc1cnc2c(C(=O)NC(C)CO)cnn2c1
InChIInChI=1S/C15H23N5O2/c1-4-19(5-2)8-12-6-16-14-13(7-17-20(14)9-12)15(22)18-11(3)10-21/h6-7,9,11,21H,4-5,8,10H2,1-3H3,(H,18,22)
InChIKeyVMTKYBAXSFYBFQ-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.68
Rot. Bonds7

About 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 56758821) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID56758821
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCN(CC)Cc1cnc2c(C(=O)NC(C)CO)cnn2c1
InChIInChI=1S/C15H23N5O2/c1-4-19(5-2)8-12-6-16-14-13(7-17-20(14)9-12)15(22)18-11(3)10-21/h6-7,9,11,21H,4-5,8,10H2,1-3H3,(H,18,22)
InChIKeyVMTKYBAXSFYBFQ-UHFFFAOYSA-N
XLogP0.68
TPSA82.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 56758821) is 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CCN(CC)Cc1cnc2c(C(=O)NC(C)CO)cnn2c1.
What is the InChIKey of 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is VMTKYBAXSFYBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-4-19(5-2)8-12-6-16-14-13(7-17-20(14)9-12)15(22)18-11(3)10-21/h6-7,9,11,21H,4-5,8,10H2,1-3H3,(H,18,22).
What are the key properties of 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 0.68, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylaminomethyl)-N-(1-hydroxypropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 56758821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).