2-[[(1S)-1-cyclopropylethyl]amino]ethanol

C7H15NO — CID 29083194

IUPAC2-[[(1S)-1-cyclopropylethyl]amino]ethanol
SMILESC[C@H](NCCO)C1CC1
InChIInChI=1S/C7H15NO/c1-6(7-2-3-7)8-4-5-9/h6-9H,2-5H2,1H3/t6-/m0/s1
InChIKeyWDCSLFGADZJTRB-LURJTMIESA-N
MW129.20 g/mol
LogP0.37
Rot. Bonds4

About 2-[[(1S)-1-cyclopropylethyl]amino]ethanol

2-[[(1S)-1-cyclopropylethyl]amino]ethanol (PubChem CID 29083194) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 2-[[(1S)-1-cyclopropylethyl]amino]ethanol.

Molecular Properties

Compound Name2-[[(1S)-1-cyclopropylethyl]amino]ethanol
PubChem CID29083194
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name2-[[(1S)-1-cyclopropylethyl]amino]ethanol
SMILESC[C@H](NCCO)C1CC1
InChIInChI=1S/C7H15NO/c1-6(7-2-3-7)8-4-5-9/h6-9H,2-5H2,1H3/t6-/m0/s1
InChIKeyWDCSLFGADZJTRB-LURJTMIESA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[[(1S)-1-cyclopropylethyl]amino]ethanol?
The IUPAC name of 2-[[(1S)-1-cyclopropylethyl]amino]ethanol (CID 29083194) is 2-[[(1S)-1-cyclopropylethyl]amino]ethanol.
What is the SMILES notation for 2-[[(1S)-1-cyclopropylethyl]amino]ethanol?
The canonical SMILES for 2-[[(1S)-1-cyclopropylethyl]amino]ethanol is C[C@H](NCCO)C1CC1.
What is the InChIKey of 2-[[(1S)-1-cyclopropylethyl]amino]ethanol?
The InChIKey is WDCSLFGADZJTRB-LURJTMIESA-N. The full InChI is InChI=1S/C7H15NO/c1-6(7-2-3-7)8-4-5-9/h6-9H,2-5H2,1H3/t6-/m0/s1.
What are the key properties of 2-[[(1S)-1-cyclopropylethyl]amino]ethanol?
2-[[(1S)-1-cyclopropylethyl]amino]ethanol has a molecular weight of 129.20 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1S)-1-cyclopropylethyl]amino]ethanol is sourced from PubChem (CID 29083194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).