sodium;3-aminopropan-1-ol;hydride

C3H10NNaO — CID 173357693

IUPACsodium;3-aminopropan-1-ol;hydride
SMILESNCCCO.[H-].[Na+]
InChIInChI=1S/C3H9NO.Na.H/c4-2-1-3-5;;/h5H,1-4H2;;/q;+1;-1
InChIKeyATJKDTHCCHXBMF-UHFFFAOYSA-N
MW99.11 g/mol
LogP-3.56
Rot. Bonds2

About sodium;3-aminopropan-1-ol;hydride

sodium;3-aminopropan-1-ol;hydride (PubChem CID 173357693) has the molecular formula C3H10NNaO and a molecular weight of 99.11 g/mol. Its IUPAC name is sodium;3-aminopropan-1-ol;hydride.

Molecular Properties

Compound Namesodium;3-aminopropan-1-ol;hydride
PubChem CID173357693
Molecular FormulaC3H10NNaO
Molecular Weight99.11 g/mol
Exact Mass99.07
IUPAC Namesodium;3-aminopropan-1-ol;hydride
SMILESNCCCO.[H-].[Na+]
InChIInChI=1S/C3H9NO.Na.H/c4-2-1-3-5;;/h5H,1-4H2;;/q;+1;-1
InChIKeyATJKDTHCCHXBMF-UHFFFAOYSA-N
XLogP-3.56
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.11
LogP ≤ 5-3.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-aminopropan-1-ol;ethane
CID 91172061
36-aminohexatriacontan-1-ol
CID 87686190
3-aminopropan-1-ol;N,N-dimethylmethanamine;dihydrate
CID 174295610
3-aminopropan-1-ol;ethenol
CID 87392158
2-aminoethanol;butane-1,4-diol
CID 135347340
6-aminohexan-1-ol;hydrochloride
CID 21259387
sodium 2-aminoethanol
CID 18941740
2-aminoethanol
CID 159229127
2-(15N)azanylethanol
CID 10329242
2-aminoethanol
CID 87375731
3-aminopropan-1-ol;2,2,2-trifluoroacetic acid
CID 87715709
3-aminopropan-1-ol;2,2-dimethylpropanoic acid
CID 88610615

Frequently Asked Questions

What is the IUPAC name of sodium;3-aminopropan-1-ol;hydride?
The IUPAC name of sodium;3-aminopropan-1-ol;hydride (CID 173357693) is sodium;3-aminopropan-1-ol;hydride.
What is the SMILES notation for sodium;3-aminopropan-1-ol;hydride?
The canonical SMILES for sodium;3-aminopropan-1-ol;hydride is NCCCO.[H-].[Na+].
What is the InChIKey of sodium;3-aminopropan-1-ol;hydride?
The InChIKey is ATJKDTHCCHXBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO.Na.H/c4-2-1-3-5;;/h5H,1-4H2;;/q;+1;-1.
What are the key properties of sodium;3-aminopropan-1-ol;hydride?
sodium;3-aminopropan-1-ol;hydride has a molecular weight of 99.11 g/mol, XLogP of -3.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;3-aminopropan-1-ol;hydride is sourced from PubChem (CID 173357693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).