N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine

C14H21N5O — CID 56901418

IUPACN-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCOCC1(Nc2nc(C)nc3c2cnn3C)CCCC1
InChIInChI=1S/C14H21N5O/c1-10-16-12(11-8-15-19(2)13(11)17-10)18-14(9-20-3)6-4-5-7-14/h8H,4-7,9H2,1-3H3,(H,16,17,18)
InChIKeyIWKRLZOIEGSTHQ-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.04
Rot. Bonds4

About N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine

N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 56901418) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID56901418
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCOCC1(Nc2nc(C)nc3c2cnn3C)CCCC1
InChIInChI=1S/C14H21N5O/c1-10-16-12(11-8-15-19(2)13(11)17-10)18-14(9-20-3)6-4-5-7-14/h8H,4-7,9H2,1-3H3,(H,16,17,18)
InChIKeyIWKRLZOIEGSTHQ-UHFFFAOYSA-N
XLogP2.04
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-2-yl)nonan-2-ol
CID 11482813
N-(2-methoxyethyl)-1-methyl-4-piperidin-1-ylpyrazolo[5,4-d]pyrimidin-6-amine
CID 7216390
N-ethyl-1-(oxan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 239500
1-(oxan-2-yl)-N-propylpyrazolo[3,4-d]pyrimidin-4-amine
CID 240425
2-[(1-Tert-butylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethanol
CID 127035703
6-cyclopentyl-4-[4-(2-methoxyethyl)-1-piperazinyl]-1-methyl-1H-pyrazolo[3,4-d]pyrimidine
CID 56888300
ethyl 3-[(6-cyclopentyl-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]butanoate
CID 56890028
N-[1-(methoxymethyl)cyclopentyl]-1-methyl-6-propylpyrazolo[3,4-d]pyrimidin-4-amine
CID 56890077
4-[3-(2-methoxyethyl)-1-piperidinyl]-1-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidine
CID 56900376
6-ethyl-4-[3-(3-methoxypropyl)-1-piperidinyl]-1-methyl-1H-pyrazolo[3,4-d]pyrimidine
CID 56903000
1-methyl-N-[(3R*,4R*)-4-(1-piperidinyl)tetrahydro-3-furanyl]-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 56907243
(6-cyclopentyl-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)[2-(diisopropylamino)ethyl]amine
CID 56909826

Frequently Asked Questions

What is the IUPAC name of N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine (CID 56901418) is N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine is COCC1(Nc2nc(C)nc3c2cnn3C)CCCC1.
What is the InChIKey of N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is IWKRLZOIEGSTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-10-16-12(11-8-15-19(2)13(11)17-10)18-14(9-20-3)6-4-5-7-14/h8H,4-7,9H2,1-3H3,(H,16,17,18).
What are the key properties of N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine?
N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 275.36 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methoxymethyl)cyclopentyl]-1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 56901418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).