N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine

C15H22N6 — CID 79705738

IUPACN-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCn1ncc2c(N(CC3CCNCC3)C3CC3)ncnc21
InChIInChI=1S/C15H22N6/c1-20-14-13(8-19-20)15(18-10-17-14)21(12-2-3-12)9-11-4-6-16-7-5-11/h8,10-12,16H,2-7,9H2,1H3
InChIKeyHDZJEDHIRONHPL-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.33
Rot. Bonds4

About N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine

N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 79705738) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID79705738
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC NameN-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCn1ncc2c(N(CC3CCNCC3)C3CC3)ncnc21
InChIInChI=1S/C15H22N6/c1-20-14-13(8-19-20)15(18-10-17-14)21(12-2-3-12)9-11-4-6-16-7-5-11/h8,10-12,16H,2-7,9H2,1H3
InChIKeyHDZJEDHIRONHPL-UHFFFAOYSA-N
XLogP1.33
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-undecyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11289252
2-decyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11380352
2-nonyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11149670
2-octyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11242074
1-(1H-Pyrazolo[3,4-d]pyrimidin-4-yl)-piperidin-4-ylamine
CID 11535873
[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperidin-4-yl]methanamine
CID 11715597
1-Ethyl-3-(1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)urea hydrochloride
CID 71223168
1-Cyclopentyl-3-(1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)urea hydrochloride
CID 71223206
1-Cyclohexyl-3-[1-(2-piperidin-1-ylethyl)pyrazolo[3,4-d]pyrimidin-4-yl]urea
CID 71223407
1-(1-(2-(azepan-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-cyclopropylurea hydrochloride
CID 71223519
N-(1-(3-(piperidin-1-yl)propyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)pivalamide
CID 71225577
4-(3,3-Dimethylpyrrolidin-1-yl)-1-(2-piperidin-1-ylethyl)pyrazolo[5,4-d]pyrimidine
CID 71225643

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine (CID 79705738) is N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine is Cn1ncc2c(N(CC3CCNCC3)C3CC3)ncnc21.
What is the InChIKey of N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is HDZJEDHIRONHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6/c1-20-14-13(8-19-20)15(18-10-17-14)21(12-2-3-12)9-11-4-6-16-7-5-11/h8,10-12,16H,2-7,9H2,1H3.
What are the key properties of N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 286.38 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 79705738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).