(3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone

C12H22N2O — CID 66475981

IUPAC(3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
SMILESCC1(C)C(C(=O)N2CCC(N)C2)C1(C)C
InChIInChI=1S/C12H22N2O/c1-11(2)9(12(11,3)4)10(15)14-6-5-8(13)7-14/h8-9H,5-7,13H2,1-4H3
InChIKeySASHGLFEXSPNCF-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.23
Rot. Bonds1

About (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone

(3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone (PubChem CID 66475981) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone.

Molecular Properties

Compound Name(3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
PubChem CID66475981
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
SMILESCC1(C)C(C(=O)N2CCC(N)C2)C1(C)C
InChIInChI=1S/C12H22N2O/c1-11(2)9(12(11,3)4)10(15)14-6-5-8(13)7-14/h8-9H,5-7,13H2,1-4H3
InChIKeySASHGLFEXSPNCF-UHFFFAOYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
The IUPAC name of (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone (CID 66475981) is (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone.
What is the SMILES notation for (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
The canonical SMILES for (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone is CC1(C)C(C(=O)N2CCC(N)C2)C1(C)C.
What is the InChIKey of (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
The InChIKey is SASHGLFEXSPNCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-11(2)9(12(11,3)4)10(15)14-6-5-8(13)7-14/h8-9H,5-7,13H2,1-4H3.
What are the key properties of (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone?
(3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone has a molecular weight of 210.32 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopyrrolidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone is sourced from PubChem (CID 66475981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).