2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol

C12H24N2O — CID 64791688

IUPAC2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol
SMILESCC1(C)CCCN1CC(N)(CO)C1CC1
InChIInChI=1S/C12H24N2O/c1-11(2)6-3-7-14(11)8-12(13,9-15)10-4-5-10/h10,15H,3-9,13H2,1-2H3
InChIKeyLKULUOFMCAVBJL-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.96
Rot. Bonds4

About 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol

2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol (PubChem CID 64791688) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol
PubChem CID64791688
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol
SMILESCC1(C)CCCN1CC(N)(CO)C1CC1
InChIInChI=1S/C12H24N2O/c1-11(2)6-3-7-14(11)8-12(13,9-15)10-4-5-10/h10,15H,3-9,13H2,1-2H3
InChIKeyLKULUOFMCAVBJL-UHFFFAOYSA-N
XLogP0.96
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol?
The IUPAC name of 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol (CID 64791688) is 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol?
The canonical SMILES for 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol is CC1(C)CCCN1CC(N)(CO)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol?
The InChIKey is LKULUOFMCAVBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-11(2)6-3-7-14(11)8-12(13,9-15)10-4-5-10/h10,15H,3-9,13H2,1-2H3.
What are the key properties of 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol?
2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol has a molecular weight of 212.34 g/mol, XLogP of 0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-(2,2-dimethylpyrrolidin-1-yl)propan-1-ol is sourced from PubChem (CID 64791688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).