2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine

C18H24N6 — CID 95725118

IUPAC2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
SMILESC[C@H](Cc1cnccn1)Nc1nc(C2CCCC2)nc2c1CNC2
InChIInChI=1S/C18H24N6/c1-12(8-14-9-19-6-7-21-14)22-18-15-10-20-11-16(15)23-17(24-18)13-4-2-3-5-13/h6-7,9,12-13,20H,2-5,8,10-11H2,1H3,(H,22,23,24)/t12-/m1/s1
InChIKeyRQBCISMXEGGPNC-GFCCVEGCSA-N
MW324.43 g/mol
LogP2.57
Rot. Bonds5

About 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine

2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine (PubChem CID 95725118) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
PubChem CID95725118
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC Name2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
SMILESC[C@H](Cc1cnccn1)Nc1nc(C2CCCC2)nc2c1CNC2
InChIInChI=1S/C18H24N6/c1-12(8-14-9-19-6-7-21-14)22-18-15-10-20-11-16(15)23-17(24-18)13-4-2-3-5-13/h6-7,9,12-13,20H,2-5,8,10-11H2,1H3,(H,22,23,24)/t12-/m1/s1
InChIKeyRQBCISMXEGGPNC-GFCCVEGCSA-N
XLogP2.57
TPSA75.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine with MolForge

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Related Compounds

N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-2-pyridin-3-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 95221672
N-(1-pyrazin-2-ylpropan-2-yl)-2-pyridin-2-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 56901267
N'-(2-cyclopentyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-yl)-N-pyridin-3-ylethane-1,2-diamine
CID 56885388
2-cycloheptyl-4-propan-2-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114741398
2-cyclopentyl-4-ethoxy-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 105493384
2-cyclopentyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
CID 56886243
2-cyclopentyl-N-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 105491818
4,6-dimethyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]pyrimidin-2-amine
CID 95129567
N-(1-pyrazin-2-ylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridin-6-amine
CID 56886252
2-cyclobutyl-4-ethoxy-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 105474416
2-cyclooctyl-4-cyclopropyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114739789
1-cyclopropyl-N-methyl-2-pyrazin-2-ylethanamine
CID 63352943

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine (CID 95725118) is 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine is C[C@H](Cc1cnccn1)Nc1nc(C2CCCC2)nc2c1CNC2.
What is the InChIKey of 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine?
The InChIKey is RQBCISMXEGGPNC-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H24N6/c1-12(8-14-9-19-6-7-21-14)22-18-15-10-20-11-16(15)23-17(24-18)13-4-2-3-5-13/h6-7,9,12-13,20H,2-5,8,10-11H2,1H3,(H,22,23,24)/t12-/m1/s1.
What are the key properties of 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine?
2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine has a molecular weight of 324.43 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 95725118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).