1-phosphanyl-4-prop-2-enylpiperidin-4-ol

C8H16NOP — CID 18686317

IUPAC1-phosphanyl-4-prop-2-enylpiperidin-4-ol
SMILESC=CCC1(O)CCN(P)CC1
InChIInChI=1S/C8H16NOP/c1-2-3-8(10)4-6-9(11)7-5-8/h2,10H,1,3-7,11H2
InChIKeyHOUUCNIFWOLQID-UHFFFAOYSA-N
MW173.20 g/mol
LogP1.18
Rot. Bonds2

About 1-phosphanyl-4-prop-2-enylpiperidin-4-ol

1-phosphanyl-4-prop-2-enylpiperidin-4-ol (PubChem CID 18686317) has the molecular formula C8H16NOP and a molecular weight of 173.20 g/mol. Its IUPAC name is 1-phosphanyl-4-prop-2-enylpiperidin-4-ol.

Molecular Properties

Compound Name1-phosphanyl-4-prop-2-enylpiperidin-4-ol
PubChem CID18686317
Molecular FormulaC8H16NOP
Molecular Weight173.20 g/mol
Exact Mass173.10
IUPAC Name1-phosphanyl-4-prop-2-enylpiperidin-4-ol
SMILESC=CCC1(O)CCN(P)CC1
InChIInChI=1S/C8H16NOP/c1-2-3-8(10)4-6-9(11)7-5-8/h2,10H,1,3-7,11H2
InChIKeyHOUUCNIFWOLQID-UHFFFAOYSA-N
XLogP1.18
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.20
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1-Methyl-4-(prop-2-en-1-yl)piperidin-4-ol
CID 1506157
1,3-Dimethyl-4-prop-2-enylpiperidin-4-ol
CID 4917707
1,1-Dimethyl-4-prop-2-enylpiperidin-1-ium-4-ol bromide
CID 24191827
1-(Methylethyl)-4-prop-2-enylpiperidin-4-ol
CID 5200463
1-Tert-butyl-4-prop-2-enylpiperidin-4-ol
CID 90419798
1-Methylsulfanyl-4-prop-2-enylpiperidin-4-ol
CID 155028709
1,1-Dimethyl-4-prop-2-enylpiperidin-1-ium-4-ol
CID 420867
(3R,4S)-1,3-dimethyl-4-prop-2-enylpiperidin-4-ol
CID 1504667
(3R,4R)-1,3-dimethyl-4-prop-2-enylpiperidin-4-ol
CID 7320635
(3S,4R)-1,3-dimethyl-4-prop-2-enylpiperidin-4-ol
CID 7320637
4-Prop-2-enylpiperidin-1-ium-4-ol
CID 7320723
(3S,4S)-1,3-dimethyl-4-prop-2-enylpiperidin-4-ol
CID 26525625

Frequently Asked Questions

What is the IUPAC name of 1-phosphanyl-4-prop-2-enylpiperidin-4-ol?
The IUPAC name of 1-phosphanyl-4-prop-2-enylpiperidin-4-ol (CID 18686317) is 1-phosphanyl-4-prop-2-enylpiperidin-4-ol.
What is the SMILES notation for 1-phosphanyl-4-prop-2-enylpiperidin-4-ol?
The canonical SMILES for 1-phosphanyl-4-prop-2-enylpiperidin-4-ol is C=CCC1(O)CCN(P)CC1.
What is the InChIKey of 1-phosphanyl-4-prop-2-enylpiperidin-4-ol?
The InChIKey is HOUUCNIFWOLQID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NOP/c1-2-3-8(10)4-6-9(11)7-5-8/h2,10H,1,3-7,11H2.
What are the key properties of 1-phosphanyl-4-prop-2-enylpiperidin-4-ol?
1-phosphanyl-4-prop-2-enylpiperidin-4-ol has a molecular weight of 173.20 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phosphanyl-4-prop-2-enylpiperidin-4-ol is sourced from PubChem (CID 18686317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).