(4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol

C10H17NO2 — CID 117274933

IUPAC(4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol
SMILESNC1(CO)CC2C3CCC(O3)C2C1
InChIInChI=1S/C10H17NO2/c11-10(5-12)3-6-7(4-10)9-2-1-8(6)13-9/h6-9,12H,1-5,11H2
InChIKeyIOBIJLSEYKRSOD-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.26
Rot. Bonds1

About (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol

(4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol (PubChem CID 117274933) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol.

Molecular Properties

Compound Name(4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol
PubChem CID117274933
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol
SMILESNC1(CO)CC2C3CCC(O3)C2C1
InChIInChI=1S/C10H17NO2/c11-10(5-12)3-6-7(4-10)9-2-1-8(6)13-9/h6-9,12H,1-5,11H2
InChIKeyIOBIJLSEYKRSOD-UHFFFAOYSA-N
XLogP0.26
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3-amino-8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanol
CID 61056846
(1-amino-3-methylcyclopentyl)methanol
CID 64516223
(1S,4S)-5-oxabicyclo[2.1.0]pentane
CID 98125749
5-amino-5-(hydroxymethyl)-2-methylcyclohexan-1-ol
CID 165490955
(5-aminospiro[1,3-dioxane-2,2'-adamantane]-5-yl)methanol
CID 99966245
1-(1,3,3a,4,5,6,7,7a-octahydro-4,7-epoxyisoindol-2-yl)-3-aminopropan-1-one;hydrochloride
CID 119335042
potassium (1R,2R,3S,4R)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
CID 85469394
(1-aminocyclopentyl)methanol
CID 157241161
(1-amino-4-ethylcyclohexyl)methanol
CID 61055822
(6R)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-ol
CID 67794006
[1-amino-3-(diethylamino)cyclopentyl]methanol
CID 79656193
1-(1,3,3a,4,5,6,7,7a-octahydro-4,7-epoxyisoindol-2-yl)-2-(8-azabicyclo[3.2.1]octan-3-yl)ethanone;hydrochloride
CID 119803643

Frequently Asked Questions

What is the IUPAC name of (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol?
The IUPAC name of (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol (CID 117274933) is (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol.
What is the SMILES notation for (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol?
The canonical SMILES for (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol is NC1(CO)CC2C3CCC(O3)C2C1.
What is the InChIKey of (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol?
The InChIKey is IOBIJLSEYKRSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c11-10(5-12)3-6-7(4-10)9-2-1-8(6)13-9/h6-9,12H,1-5,11H2.
What are the key properties of (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol?
(4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol has a molecular weight of 183.25 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-10-oxatricyclo[5.2.1.02,6]decan-4-yl)methanol is sourced from PubChem (CID 117274933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).