(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine

C9H19N — CID 58977160

IUPAC(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1[C@H](C)CC[C@H]1C
InChIInChI=1S/C9H19N/c1-7(2)10-8(3)5-6-9(10)4/h7-9H,5-6H2,1-4H3/t8-,9-/m1/s1
InChIKeyCQZASKWWWQVEHM-RKDXNWHRSA-N
MW141.26 g/mol
LogP2.27
Rot. Bonds1

About (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine

(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine (PubChem CID 58977160) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine
PubChem CID58977160
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1[C@H](C)CC[C@H]1C
InChIInChI=1S/C9H19N/c1-7(2)10-8(3)5-6-9(10)4/h7-9H,5-6H2,1-4H3/t8-,9-/m1/s1
InChIKeyCQZASKWWWQVEHM-RKDXNWHRSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine?
The IUPAC name of (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine (CID 58977160) is (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine.
What is the SMILES notation for (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine?
The canonical SMILES for (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine is CC(C)N1[C@H](C)CC[C@H]1C.
What is the InChIKey of (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine?
The InChIKey is CQZASKWWWQVEHM-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H19N/c1-7(2)10-8(3)5-6-9(10)4/h7-9H,5-6H2,1-4H3/t8-,9-/m1/s1.
What are the key properties of (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine?
(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine has a molecular weight of 141.26 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 58977160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).