N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide

C16H24N6O — CID 53181420

IUPACN,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide
SMILESCCN(CC)C(=O)c1nc(N2CCCCC2)c2cnn(C)c2n1
InChIInChI=1S/C16H24N6O/c1-4-21(5-2)16(23)13-18-14-12(11-17-20(14)3)15(19-13)22-9-7-6-8-10-22/h11H,4-10H2,1-3H3
InChIKeyOVSYDODIQOIIJI-UHFFFAOYSA-N
MW316.41 g/mol
LogP1.84
Rot. Bonds4

About N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide

N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide (PubChem CID 53181420) has the molecular formula C16H24N6O and a molecular weight of 316.41 g/mol. Its IUPAC name is N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide
PubChem CID53181420
Molecular FormulaC16H24N6O
Molecular Weight316.41 g/mol
Exact Mass316.20
IUPAC NameN,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide
SMILESCCN(CC)C(=O)c1nc(N2CCCCC2)c2cnn(C)c2n1
InChIInChI=1S/C16H24N6O/c1-4-21(5-2)16(23)13-18-14-12(11-17-20(14)3)15(19-13)22-9-7-6-8-10-22/h11H,4-10H2,1-3H3
InChIKeyOVSYDODIQOIIJI-UHFFFAOYSA-N
XLogP1.84
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide?
The IUPAC name of N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide (CID 53181420) is N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide.
What is the SMILES notation for N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide?
The canonical SMILES for N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide is CCN(CC)C(=O)c1nc(N2CCCCC2)c2cnn(C)c2n1.
What is the InChIKey of N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide?
The InChIKey is OVSYDODIQOIIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O/c1-4-21(5-2)16(23)13-18-14-12(11-17-20(14)3)15(19-13)22-9-7-6-8-10-22/h11H,4-10H2,1-3H3.
What are the key properties of N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide?
N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide has a molecular weight of 316.41 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 53181420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).