N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C16H21N5O — CID 53171801

IUPACN-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESO=C(NC1CCCC1)c1cc(N2CCCC2)n2nccc2n1
InChIInChI=1S/C16H21N5O/c22-16(18-12-5-1-2-6-12)13-11-15(20-9-3-4-10-20)21-14(19-13)7-8-17-21/h7-8,11-12H,1-6,9-10H2,(H,18,22)
InChIKeyWCOPBRFKOJTIQW-UHFFFAOYSA-N
MW299.38 g/mol
LogP2.00
Rot. Bonds3

About N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 53171801) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID53171801
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC NameN-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESO=C(NC1CCCC1)c1cc(N2CCCC2)n2nccc2n1
InChIInChI=1S/C16H21N5O/c22-16(18-12-5-1-2-6-12)13-11-15(20-9-3-4-10-20)21-14(19-13)7-8-17-21/h7-8,11-12H,1-6,9-10H2,(H,18,22)
InChIKeyWCOPBRFKOJTIQW-UHFFFAOYSA-N
XLogP2.00
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 53171801) is N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide is O=C(NC1CCCC1)c1cc(N2CCCC2)n2nccc2n1.
What is the InChIKey of N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is WCOPBRFKOJTIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O/c22-16(18-12-5-1-2-6-12)13-11-15(20-9-3-4-10-20)21-14(19-13)7-8-17-21/h7-8,11-12H,1-6,9-10H2,(H,18,22).
What are the key properties of N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 299.38 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 53171801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).