(3R)-3-(phosphanylamino)butan-1-ol

C4H12NOP — CID 90206966

IUPAC(3R)-3-(phosphanylamino)butan-1-ol
SMILESC[C@H](CCO)NP
InChIInChI=1S/C4H12NOP/c1-4(5-7)2-3-6/h4-6H,2-3,7H2,1H3/t4-/m1/s1
InChIKeyDATXEIQVFYXAHY-SCSAIBSYSA-N
MW121.12 g/mol
LogP0.14
Rot. Bonds3

About (3R)-3-(phosphanylamino)butan-1-ol

(3R)-3-(phosphanylamino)butan-1-ol (PubChem CID 90206966) has the molecular formula C4H12NOP and a molecular weight of 121.12 g/mol. Its IUPAC name is (3R)-3-(phosphanylamino)butan-1-ol.

Molecular Properties

Compound Name(3R)-3-(phosphanylamino)butan-1-ol
PubChem CID90206966
Molecular FormulaC4H12NOP
Molecular Weight121.12 g/mol
Exact Mass121.07
IUPAC Name(3R)-3-(phosphanylamino)butan-1-ol
SMILESC[C@H](CCO)NP
InChIInChI=1S/C4H12NOP/c1-4(5-7)2-3-6/h4-6H,2-3,7H2,1H3/t4-/m1/s1
InChIKeyDATXEIQVFYXAHY-SCSAIBSYSA-N
XLogP0.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.12
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(phosphanylamino)butan-1-ol?
The IUPAC name of (3R)-3-(phosphanylamino)butan-1-ol (CID 90206966) is (3R)-3-(phosphanylamino)butan-1-ol.
What is the SMILES notation for (3R)-3-(phosphanylamino)butan-1-ol?
The canonical SMILES for (3R)-3-(phosphanylamino)butan-1-ol is C[C@H](CCO)NP.
What is the InChIKey of (3R)-3-(phosphanylamino)butan-1-ol?
The InChIKey is DATXEIQVFYXAHY-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H12NOP/c1-4(5-7)2-3-6/h4-6H,2-3,7H2,1H3/t4-/m1/s1.
What are the key properties of (3R)-3-(phosphanylamino)butan-1-ol?
(3R)-3-(phosphanylamino)butan-1-ol has a molecular weight of 121.12 g/mol, XLogP of 0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(phosphanylamino)butan-1-ol is sourced from PubChem (CID 90206966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).