2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine

C11H17N3 — CID 89274443

IUPAC2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine
SMILESCC(C)N1CCC[C@@H]1c1ncccn1
InChIInChI=1S/C11H17N3/c1-9(2)14-8-3-5-10(14)11-12-6-4-7-13-11/h4,6-7,9-10H,3,5,8H2,1-2H3/t10-/m1/s1
InChIKeyLSZPZQHUHYTJRM-SNVBAGLBSA-N
MW191.28 g/mol
LogP2.02
Rot. Bonds2

About 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine

2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine (PubChem CID 89274443) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine.

Molecular Properties

Compound Name2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine
PubChem CID89274443
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine
SMILESCC(C)N1CCC[C@@H]1c1ncccn1
InChIInChI=1S/C11H17N3/c1-9(2)14-8-3-5-10(14)11-12-6-4-7-13-11/h4,6-7,9-10H,3,5,8H2,1-2H3/t10-/m1/s1
InChIKeyLSZPZQHUHYTJRM-SNVBAGLBSA-N
XLogP2.02
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine?
The IUPAC name of 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine (CID 89274443) is 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine.
What is the SMILES notation for 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine?
The canonical SMILES for 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine is CC(C)N1CCC[C@@H]1c1ncccn1.
What is the InChIKey of 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine?
The InChIKey is LSZPZQHUHYTJRM-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H17N3/c1-9(2)14-8-3-5-10(14)11-12-6-4-7-13-11/h4,6-7,9-10H,3,5,8H2,1-2H3/t10-/m1/s1.
What are the key properties of 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine?
2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine has a molecular weight of 191.28 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine is sourced from PubChem (CID 89274443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).