4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

C12H19N5 — CID 59777309

IUPAC4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
SMILESCN[C@@H]1CCN(c2nc(N)nc3c2CCC3)C1
InChIInChI=1S/C12H19N5/c1-14-8-5-6-17(7-8)11-9-3-2-4-10(9)15-12(13)16-11/h8,14H,2-7H2,1H3,(H2,13,15,16)/t8-/m1/s1
InChIKeyHPHJKTSBAPAIAW-MRVPVSSYSA-N
MW233.32 g/mol
LogP0.35
Rot. Bonds2

About 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine (PubChem CID 59777309) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
PubChem CID59777309
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
SMILESCN[C@@H]1CCN(c2nc(N)nc3c2CCC3)C1
InChIInChI=1S/C12H19N5/c1-14-8-5-6-17(7-8)11-9-3-2-4-10(9)15-12(13)16-11/h8,14H,2-7H2,1H3,(H2,13,15,16)/t8-/m1/s1
InChIKeyHPHJKTSBAPAIAW-MRVPVSSYSA-N
XLogP0.35
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The IUPAC name of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine (CID 59777309) is 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine.
What is the SMILES notation for 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The canonical SMILES for 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine is CN[C@@H]1CCN(c2nc(N)nc3c2CCC3)C1.
What is the InChIKey of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The InChIKey is HPHJKTSBAPAIAW-MRVPVSSYSA-N. The full InChI is InChI=1S/C12H19N5/c1-14-8-5-6-17(7-8)11-9-3-2-4-10(9)15-12(13)16-11/h8,14H,2-7H2,1H3,(H2,13,15,16)/t8-/m1/s1.
What are the key properties of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine has a molecular weight of 233.32 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine is sourced from PubChem (CID 59777309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).