3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

C15H23N5 — CID 117103187

IUPAC3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC(C)N1CCC(Cc2cnn3c(N)ccnc23)CC1
InChIInChI=1S/C15H23N5/c1-11(2)19-7-4-12(5-8-19)9-13-10-18-20-14(16)3-6-17-15(13)20/h3,6,10-12H,4-5,7-9,16H2,1-2H3
InChIKeyIJUWCGZMQWMZMQ-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.97
Rot. Bonds3

About 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 117103187) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID117103187
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC(C)N1CCC(Cc2cnn3c(N)ccnc23)CC1
InChIInChI=1S/C15H23N5/c1-11(2)19-7-4-12(5-8-19)9-13-10-18-20-14(16)3-6-17-15(13)20/h3,6,10-12H,4-5,7-9,16H2,1-2H3
InChIKeyIJUWCGZMQWMZMQ-UHFFFAOYSA-N
XLogP1.97
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 117103187) is 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine is CC(C)N1CCC(Cc2cnn3c(N)ccnc23)CC1.
What is the InChIKey of 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is IJUWCGZMQWMZMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-11(2)19-7-4-12(5-8-19)9-13-10-18-20-14(16)3-6-17-15(13)20/h3,6,10-12H,4-5,7-9,16H2,1-2H3.
What are the key properties of 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine?
3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 273.38 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 117103187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).