N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine

C14H22N6O — CID 7216390

IUPACN-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine
SMILESCOCCNc1nc(N2CCCCC2)c2cnn(C)c2n1
InChIInChI=1S/C14H22N6O/c1-19-12-11(10-16-19)13(20-7-4-3-5-8-20)18-14(17-12)15-6-9-21-2/h10H,3-9H2,1-2H3,(H,15,17,18)
InChIKeyUMYUKEZKJZJXJO-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.41
Rot. Bonds5

About N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine

N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine (PubChem CID 7216390) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine
PubChem CID7216390
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC NameN-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine
SMILESCOCCNc1nc(N2CCCCC2)c2cnn(C)c2n1
InChIInChI=1S/C14H22N6O/c1-19-12-11(10-16-19)13(20-7-4-3-5-8-20)18-14(17-12)15-6-9-21-2/h10H,3-9H2,1-2H3,(H,15,17,18)
InChIKeyUMYUKEZKJZJXJO-UHFFFAOYSA-N
XLogP1.41
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,2-dimethoxyethyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 7197187
2-(ethyl(1-methyl-4-(piperidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino)ethanol
CID 7216404
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
N-(1-(2-(Piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)pivalamide maleate
CID 71223252
N-(1-(3-(piperidin-1-yl)propyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)pivalamide
CID 71225577
1-(1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3-propylurea
CID 71225882
N-ethyl-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 219754
1-(4-Piperidinylmethyl)-1H-pyrazolo(3,4-d)pyrimidin-4-amine
CID 56835766
2-Heptyl-2H-pyrazolo[3,4-d]pyrimidin-4-ylamine
CID 11253284
4-(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)morpholine
CID 653309
2,2-dimethyl-N-[1-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-yl]propanamide
CID 71223493

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine?
The IUPAC name of N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine (CID 7216390) is N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine.
What is the SMILES notation for N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine?
The canonical SMILES for N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine is COCCNc1nc(N2CCCCC2)c2cnn(C)c2n1.
What is the InChIKey of N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine?
The InChIKey is UMYUKEZKJZJXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-19-12-11(10-16-19)13(20-7-4-3-5-8-20)18-14(17-12)15-6-9-21-2/h10H,3-9H2,1-2H3,(H,15,17,18).
What are the key properties of N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine?
N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine has a molecular weight of 290.37 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine is sourced from PubChem (CID 7216390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).