4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine

C10H17N5 — CID 53258370

IUPAC4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine
SMILESCCc1cc(N2CC[C@@H](N)C2)nc(N)n1
InChIInChI=1S/C10H17N5/c1-2-8-5-9(14-10(12)13-8)15-4-3-7(11)6-15/h5,7H,2-4,6,11H2,1H3,(H2,12,13,14)/t7-/m1/s1
InChIKeyAZBCGUPNGHWKDL-SSDOTTSWSA-N
MW207.28 g/mol
LogP0.16
Rot. Bonds2

About 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine

4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine (PubChem CID 53258370) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine
PubChem CID53258370
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine
SMILESCCc1cc(N2CC[C@@H](N)C2)nc(N)n1
InChIInChI=1S/C10H17N5/c1-2-8-5-9(14-10(12)13-8)15-4-3-7(11)6-15/h5,7H,2-4,6,11H2,1H3,(H2,12,13,14)/t7-/m1/s1
InChIKeyAZBCGUPNGHWKDL-SSDOTTSWSA-N
XLogP0.16
TPSA81.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine?
The IUPAC name of 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine (CID 53258370) is 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine.
What is the SMILES notation for 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine?
The canonical SMILES for 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine is CCc1cc(N2CC[C@@H](N)C2)nc(N)n1.
What is the InChIKey of 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine?
The InChIKey is AZBCGUPNGHWKDL-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H17N5/c1-2-8-5-9(14-10(12)13-8)15-4-3-7(11)6-15/h5,7H,2-4,6,11H2,1H3,(H2,12,13,14)/t7-/m1/s1.
What are the key properties of 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine?
4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine has a molecular weight of 207.28 g/mol, XLogP of 0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-aminopyrrolidin-1-yl]-6-ethylpyrimidin-2-amine is sourced from PubChem (CID 53258370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).