7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine

C15H22N4 — CID 90791059

IUPAC7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine
SMILESCCc1cc(CC2CCNCC2)nc2c(C)cnn12
InChIInChI=1S/C15H22N4/c1-3-14-9-13(8-12-4-6-16-7-5-12)18-15-11(2)10-17-19(14)15/h9-10,12,16H,3-8H2,1-2H3
InChIKeyNBZKUYWVPDOIJW-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.14
Rot. Bonds3

About 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine

7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 90791059) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine
PubChem CID90791059
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine
SMILESCCc1cc(CC2CCNCC2)nc2c(C)cnn12
InChIInChI=1S/C15H22N4/c1-3-14-9-13(8-12-4-6-16-7-5-12)18-15-11(2)10-17-19(14)15/h9-10,12,16H,3-8H2,1-2H3
InChIKeyNBZKUYWVPDOIJW-UHFFFAOYSA-N
XLogP2.14
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-chloro-5-(cyclohexylmethyl)-3-methylpyrazolo[1,5-a]pyrimidine
CID 89351662
5-ethyl-3-(piperidin-4-ylmethyl)-1,2,4-triazine
CID 105459668
5,6-dimethyl-2-(piperidin-4-ylmethyl)-1,3-benzothiazole
CID 84638397
9-hydroxy-2-(piperidin-4-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
CID 115054753
6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 80563627
2-(piperidin-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ol
CID 117156548
4-[(3-ethylimidazol-4-yl)methyl]piperidine
CID 84665127
5-methyl-2-(piperidin-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117155315
4-methyl-6-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine
CID 83858474
8-fluoro-2-(piperidin-4-ylmethyl)imidazo[1,2-a]pyridine
CID 105492803
N,6-diethyl-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 79720099
5-bromo-3-(piperidin-4-ylmethyl)pyridazine
CID 117105469

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine (CID 90791059) is 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine is CCc1cc(CC2CCNCC2)nc2c(C)cnn12.
What is the InChIKey of 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is NBZKUYWVPDOIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-3-14-9-13(8-12-4-6-16-7-5-12)18-15-11(2)10-17-19(14)15/h9-10,12,16H,3-8H2,1-2H3.
What are the key properties of 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine?
7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 258.37 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-3-methyl-5-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 90791059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).