4-dihydroxysilylpentane-1,3-diamine

C5H16N2O2Si — CID 173135737

IUPAC4-dihydroxysilylpentane-1,3-diamine
SMILESCC(C(N)CCN)[SiH](O)O
InChIInChI=1S/C5H16N2O2Si/c1-4(10(8)9)5(7)2-3-6/h4-5,8-10H,2-3,6-7H2,1H3
InChIKeyWFGHMRYZUSADRS-UHFFFAOYSA-N
MW164.28 g/mol
LogP-1.74
Rot. Bonds4

About 4-dihydroxysilylpentane-1,3-diamine

4-dihydroxysilylpentane-1,3-diamine (PubChem CID 173135737) has the molecular formula C5H16N2O2Si and a molecular weight of 164.28 g/mol. Its IUPAC name is 4-dihydroxysilylpentane-1,3-diamine.

Molecular Properties

Compound Name4-dihydroxysilylpentane-1,3-diamine
PubChem CID173135737
Molecular FormulaC5H16N2O2Si
Molecular Weight164.28 g/mol
Exact Mass164.10
IUPAC Name4-dihydroxysilylpentane-1,3-diamine
SMILESCC(C(N)CCN)[SiH](O)O
InChIInChI=1S/C5H16N2O2Si/c1-4(10(8)9)5(7)2-3-6/h4-5,8-10H,2-3,6-7H2,1H3
InChIKeyWFGHMRYZUSADRS-UHFFFAOYSA-N
XLogP-1.74
TPSA92.50 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.28
LogP ≤ 5-1.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

pentane-1,3,4-triamine
CID 18366520
1-N,1-N,2-trimethylpentane-1,3,5-triamine
CID 87352361
1,4-diamino-2-methylbutane-1-sulfonic acid
CID 158087776
5,8,10-triaminodecan-2-one
CID 15920060
nonane-1,3,4-triamine
CID 140867802
(4S)-1,4-diaminohexan-3-ol
CID 149307886
4-aminobutane-2-sulfonic acid;phosphoric acid
CID 175430155
1,3-diaminopropan-1-ol
CID 10419133
sodium;1,4-diamino-2-methylbutane-1-sulfonic acid;hydride
CID 174769406
4-aminobutan-2-ylboronic acid
CID 14026844
(2R,3S)-5-amino-2,3-dimethylpentan-1-ol
CID 174320236
(2S)-2-methylbutane-1,4-diamine
CID 51382069

Frequently Asked Questions

What is the IUPAC name of 4-dihydroxysilylpentane-1,3-diamine?
The IUPAC name of 4-dihydroxysilylpentane-1,3-diamine (CID 173135737) is 4-dihydroxysilylpentane-1,3-diamine.
What is the SMILES notation for 4-dihydroxysilylpentane-1,3-diamine?
The canonical SMILES for 4-dihydroxysilylpentane-1,3-diamine is CC(C(N)CCN)[SiH](O)O.
What is the InChIKey of 4-dihydroxysilylpentane-1,3-diamine?
The InChIKey is WFGHMRYZUSADRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H16N2O2Si/c1-4(10(8)9)5(7)2-3-6/h4-5,8-10H,2-3,6-7H2,1H3.
What are the key properties of 4-dihydroxysilylpentane-1,3-diamine?
4-dihydroxysilylpentane-1,3-diamine has a molecular weight of 164.28 g/mol, XLogP of -1.74, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dihydroxysilylpentane-1,3-diamine is sourced from PubChem (CID 173135737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).