3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one

C14H26N2O — CID 79350265

IUPAC3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
SMILESCC(C)NC1CCN(C2C(C)(C)C2(C)C)C1=O
InChIInChI=1S/C14H26N2O/c1-9(2)15-10-7-8-16(11(10)17)12-13(3,4)14(12,5)6/h9-10,12,15H,7-8H2,1-6H3
InChIKeyMKMQOFGSTZEOOG-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.02
Rot. Bonds3

About 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one

3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one (PubChem CID 79350265) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one.

Molecular Properties

Compound Name3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
PubChem CID79350265
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
SMILESCC(C)NC1CCN(C2C(C)(C)C2(C)C)C1=O
InChIInChI=1S/C14H26N2O/c1-9(2)15-10-7-8-16(11(10)17)12-13(3,4)14(12,5)6/h9-10,12,15H,7-8H2,1-6H3
InChIKeyMKMQOFGSTZEOOG-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
The IUPAC name of 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one (CID 79350265) is 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one.
What is the SMILES notation for 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
The canonical SMILES for 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one is CC(C)NC1CCN(C2C(C)(C)C2(C)C)C1=O.
What is the InChIKey of 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
The InChIKey is MKMQOFGSTZEOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-9(2)15-10-7-8-16(11(10)17)12-13(3,4)14(12,5)6/h9-10,12,15H,7-8H2,1-6H3.
What are the key properties of 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one has a molecular weight of 238.37 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one is sourced from PubChem (CID 79350265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).