1-piperidin-1-ylpropan-2-ol;yttrium

C8H16NOY- — CID 59057948

IUPAC1-piperidin-1-ylpropan-2-ol;yttrium
SMILES[CH2-]C(O)CN1CCCCC1.[Y]
InChIInChI=1S/C8H16NO.Y/c1-8(10)7-9-5-3-2-4-6-9;/h8,10H,1-7H2;/q-1;
InChIKeyJWVUDAIDSVZOAS-UHFFFAOYSA-N
MW231.13 g/mol
LogP0.66
Rot. Bonds2

About 1-piperidin-1-ylpropan-2-ol;yttrium

1-piperidin-1-ylpropan-2-ol;yttrium (PubChem CID 59057948) has the molecular formula C8H16NOY- and a molecular weight of 231.13 g/mol. Its IUPAC name is 1-piperidin-1-ylpropan-2-ol;yttrium.

Molecular Properties

Compound Name1-piperidin-1-ylpropan-2-ol;yttrium
PubChem CID59057948
Molecular FormulaC8H16NOY-
Molecular Weight231.13 g/mol
Exact Mass231.03
IUPAC Name1-piperidin-1-ylpropan-2-ol;yttrium
SMILES[CH2-]C(O)CN1CCCCC1.[Y]
InChIInChI=1S/C8H16NO.Y/c1-8(10)7-9-5-3-2-4-6-9;/h8,10H,1-7H2;/q-1;
InChIKeyJWVUDAIDSVZOAS-UHFFFAOYSA-N
XLogP0.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.13
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

1,3-dipyrrolidin-1-ylpropan-2-ol
CID 57126359
1-(azacyclododec-1-yl)propan-2-ol
CID 58868254
(2S)-3-piperidin-1-ylpropane-1,2-diol
CID 854495
(2S)-1-chloro-3-piperidin-1-ylpropan-2-ol
CID 102309781
(2S)-1-amino-3-(azonan-1-yl)propan-2-ol
CID 131048167
1-(azonan-1-yl)butan-2-ol
CID 130671766
1-amino-3-(azonan-1-yl)propan-2-ol
CID 127001298
3-(azocan-1-yl)-1,1,1-trifluoropropan-2-ol
CID 63901840
3-(azocan-1-yl)-2-hydroxypropanoic acid
CID 130593606
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
4-(azepan-1-yl)-3-hydroxybutanoic acid
CID 82774888
2-fluoro-3-piperidin-1-ylpropan-1-amine
CID 84651060

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-ylpropan-2-ol;yttrium?
The IUPAC name of 1-piperidin-1-ylpropan-2-ol;yttrium (CID 59057948) is 1-piperidin-1-ylpropan-2-ol;yttrium.
What is the SMILES notation for 1-piperidin-1-ylpropan-2-ol;yttrium?
The canonical SMILES for 1-piperidin-1-ylpropan-2-ol;yttrium is [CH2-]C(O)CN1CCCCC1.[Y].
What is the InChIKey of 1-piperidin-1-ylpropan-2-ol;yttrium?
The InChIKey is JWVUDAIDSVZOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NO.Y/c1-8(10)7-9-5-3-2-4-6-9;/h8,10H,1-7H2;/q-1;.
What are the key properties of 1-piperidin-1-ylpropan-2-ol;yttrium?
1-piperidin-1-ylpropan-2-ol;yttrium has a molecular weight of 231.13 g/mol, XLogP of 0.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-ylpropan-2-ol;yttrium is sourced from PubChem (CID 59057948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).