2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol

C12H24N2O — CID 117237105

IUPAC2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
SMILESCC(C)N1CCC(C(O)CNC2CC2)C1
InChIInChI=1S/C12H24N2O/c1-9(2)14-6-5-10(8-14)12(15)7-13-11-3-4-11/h9-13,15H,3-8H2,1-2H3
InChIKeyKBWINBXSSCKDPC-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.83
Rot. Bonds5

About 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol

2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol (PubChem CID 117237105) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
PubChem CID117237105
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
SMILESCC(C)N1CCC(C(O)CNC2CC2)C1
InChIInChI=1S/C12H24N2O/c1-9(2)14-6-5-10(8-14)12(15)7-13-11-3-4-11/h9-13,15H,3-8H2,1-2H3
InChIKeyKBWINBXSSCKDPC-UHFFFAOYSA-N
XLogP0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
CID 117237131
(2R)-1-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 93033302
N'-cyclobutyl-2-(1-propan-2-ylpyrrolidin-3-yl)propane-1,3-diamine
CID 117237573
N'-cyclopentyl-2-(1-propan-2-ylpyrrolidin-3-yl)propane-1,3-diamine
CID 117237587
3-methyl-1-[(1-propan-2-ylpyrrolidin-3-yl)amino]butan-2-ol
CID 115689315
ethane;1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
CID 176573515
N-[2-(4-propan-2-ylpiperidin-1-yl)propyl]cyclopropanamine
CID 103503204
1,1-difluoro-3-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 103788055
N-(3-methyl-2-propan-2-ylbutyl)-1-propan-2-ylpyrrolidin-3-amine
CID 102904528
1-(1-propan-2-ylpiperidin-4-yl)ethane-1,2-diol
CID 117238997
N-ethyl-1-propan-2-ylpiperidin-4-amine
CID 24692919
4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol
CID 103784472

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
The IUPAC name of 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol (CID 117237105) is 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol.
What is the SMILES notation for 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
The canonical SMILES for 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol is CC(C)N1CCC(C(O)CNC2CC2)C1.
What is the InChIKey of 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
The InChIKey is KBWINBXSSCKDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)14-6-5-10(8-14)12(15)7-13-11-3-4-11/h9-13,15H,3-8H2,1-2H3.
What are the key properties of 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol has a molecular weight of 212.34 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol is sourced from PubChem (CID 117237105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).