N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine

C15H23N5 — CID 70747932

IUPACN,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine
SMILESCC(C)c1cc(N2CCC(N(C)C)C2)n2nccc2n1
InChIInChI=1S/C15H23N5/c1-11(2)13-9-15(20-14(17-13)5-7-16-20)19-8-6-12(10-19)18(3)4/h5,7,9,11-12H,6,8,10H2,1-4H3
InChIKeyLLGGZXXQOZEXTL-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.99
Rot. Bonds3

About N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine

N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine (PubChem CID 70747932) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine
PubChem CID70747932
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC NameN,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine
SMILESCC(C)c1cc(N2CCC(N(C)C)C2)n2nccc2n1
InChIInChI=1S/C15H23N5/c1-11(2)13-9-15(20-14(17-13)5-7-16-20)19-8-6-12(10-19)18(3)4/h5,7,9,11-12H,6,8,10H2,1-4H3
InChIKeyLLGGZXXQOZEXTL-UHFFFAOYSA-N
XLogP1.99
TPSA36.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine?
The IUPAC name of N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine (CID 70747932) is N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine is CC(C)c1cc(N2CCC(N(C)C)C2)n2nccc2n1.
What is the InChIKey of N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine?
The InChIKey is LLGGZXXQOZEXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-11(2)13-9-15(20-14(17-13)5-7-16-20)19-8-6-12(10-19)18(3)4/h5,7,9,11-12H,6,8,10H2,1-4H3.
What are the key properties of N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine?
N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine has a molecular weight of 273.38 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-amine is sourced from PubChem (CID 70747932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).