1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea

C16H35N3O5Si — CID 59782824

IUPAC1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea
SMILESCCO[Si](CCCNC(=O)NCCN1CCOCC1)(OCC)OCC
InChIInChI=1S/C16H35N3O5Si/c1-4-22-25(23-5-2,24-6-3)15-7-8-17-16(20)18-9-10-19-11-13-21-14-12-19/h4-15H2,1-3H3,(H2,17,18,20)
InChIKeyRVEPDRWIXXXHGC-UHFFFAOYSA-N
MW377.56 g/mol
LogP1.06
Rot. Bonds13

About 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea

1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea (PubChem CID 59782824) has the molecular formula C16H35N3O5Si and a molecular weight of 377.56 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea
PubChem CID59782824
Molecular FormulaC16H35N3O5Si
Molecular Weight377.56 g/mol
Exact Mass377.23
IUPAC Name1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea
SMILESCCO[Si](CCCNC(=O)NCCN1CCOCC1)(OCC)OCC
InChIInChI=1S/C16H35N3O5Si/c1-4-22-25(23-5-2,24-6-3)15-7-8-17-16(20)18-9-10-19-11-13-21-14-12-19/h4-15H2,1-3H3,(H2,17,18,20)
InChIKeyRVEPDRWIXXXHGC-UHFFFAOYSA-N
XLogP1.06
TPSA81.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.56
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-(2-morpholin-4-ylethyl)-3-pentylurea
CID 108988288
1-(2-morpholin-4-ylethyl)-3-propylurea
CID 4583080
1-(3-triethoxysilylpropyl)-3-[6-(3-triethoxysilylpropylcarbamoylamino)hexyl]urea
CID 87657796
N-(4-triethoxysilylbutyl)morpholine-4-carboxamide
CID 123308954
1-octyl-3-(3-triethoxysilylpropyl)urea
CID 102048521
1-(2-methoxyethoxymethyl)-3-(2-morpholin-4-ylethyl)urea
CID 108894367
CID 102321543
CID 102321543
1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea
CID 117235873
2-[(2-morpholin-4-ylethylcarbamoylamino)methyl]butanoic acid
CID 65218493
2-[2-(2-morpholin-4-ylethylcarbamoylamino)ethoxy]acetic acid
CID 79463716
2,2-dimethyl-N-(2-morpholin-4-ylethyl)-N'-pentylpropanediamide
CID 108960403
6-(3-morpholin-4-ylpropylcarbamoylamino)hexanoic acid
CID 61194288

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea (CID 59782824) is 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea is CCO[Si](CCCNC(=O)NCCN1CCOCC1)(OCC)OCC.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea?
The InChIKey is RVEPDRWIXXXHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O5Si/c1-4-22-25(23-5-2,24-6-3)15-7-8-17-16(20)18-9-10-19-11-13-21-14-12-19/h4-15H2,1-3H3,(H2,17,18,20).
What are the key properties of 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea?
1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea has a molecular weight of 377.56 g/mol, XLogP of 1.06, 13 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea is sourced from PubChem (CID 59782824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).