2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol

C10H21NO — CID 89249360

IUPAC2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol
SMILESCCC(C)C1CC1N(C)CCO
InChIInChI=1S/C10H21NO/c1-4-8(2)9-7-10(9)11(3)5-6-12/h8-10,12H,4-7H2,1-3H3
InChIKeyZTFUGMGAMWSQJQ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.35
Rot. Bonds5

About 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol

2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol (PubChem CID 89249360) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol.

Molecular Properties

Compound Name2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol
PubChem CID89249360
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol
SMILESCCC(C)C1CC1N(C)CCO
InChIInChI=1S/C10H21NO/c1-4-8(2)9-7-10(9)11(3)5-6-12/h8-10,12H,4-7H2,1-3H3
InChIKeyZTFUGMGAMWSQJQ-UHFFFAOYSA-N
XLogP1.35
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol?
The IUPAC name of 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol (CID 89249360) is 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol.
What is the SMILES notation for 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol?
The canonical SMILES for 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol is CCC(C)C1CC1N(C)CCO.
What is the InChIKey of 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol?
The InChIKey is ZTFUGMGAMWSQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-8(2)9-7-10(9)11(3)5-6-12/h8-10,12H,4-7H2,1-3H3.
What are the key properties of 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol?
2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol has a molecular weight of 171.28 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-butan-2-ylcyclopropyl)-methylamino]ethanol is sourced from PubChem (CID 89249360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).