2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol

C10H17NO2 — CID 102646693

IUPAC2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol
SMILESNCC(O)(C1=CCCCO1)C1CC1
InChIInChI=1S/C10H17NO2/c11-7-10(12,8-4-5-8)9-3-1-2-6-13-9/h3,8,12H,1-2,4-7,11H2
InChIKeyUWKDMAKNCPUOAW-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.78
Rot. Bonds3

About 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol

2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol (PubChem CID 102646693) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol
PubChem CID102646693
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol
SMILESNCC(O)(C1=CCCCO1)C1CC1
InChIInChI=1S/C10H17NO2/c11-7-10(12,8-4-5-8)9-3-1-2-6-13-9/h3,8,12H,1-2,4-7,11H2
InChIKeyUWKDMAKNCPUOAW-UHFFFAOYSA-N
XLogP0.78
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol?
The IUPAC name of 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol (CID 102646693) is 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol.
What is the SMILES notation for 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol?
The canonical SMILES for 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol is NCC(O)(C1=CCCCO1)C1CC1.
What is the InChIKey of 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol?
The InChIKey is UWKDMAKNCPUOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c11-7-10(12,8-4-5-8)9-3-1-2-6-13-9/h3,8,12H,1-2,4-7,11H2.
What are the key properties of 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol?
2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol has a molecular weight of 183.25 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol is sourced from PubChem (CID 102646693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).