(5-amino-5-dimethoxysilylpentyl)urea

C8H21N3O3Si — CID 175187119

IUPAC(5-amino-5-dimethoxysilylpentyl)urea
SMILESCO[SiH](OC)C(N)CCCCNC(N)=O
InChIInChI=1S/C8H21N3O3Si/c1-13-15(14-2)7(9)5-3-4-6-11-8(10)12/h7,15H,3-6,9H2,1-2H3,(H3,10,11,12)
InChIKeyKMBBKPFJMLMYLA-UHFFFAOYSA-N
MW235.36 g/mol
LogP-0.80
Rot. Bonds8

About (5-amino-5-dimethoxysilylpentyl)urea

(5-amino-5-dimethoxysilylpentyl)urea (PubChem CID 175187119) has the molecular formula C8H21N3O3Si and a molecular weight of 235.36 g/mol. Its IUPAC name is (5-amino-5-dimethoxysilylpentyl)urea.

Molecular Properties

Compound Name(5-amino-5-dimethoxysilylpentyl)urea
PubChem CID175187119
Molecular FormulaC8H21N3O3Si
Molecular Weight235.36 g/mol
Exact Mass235.14
IUPAC Name(5-amino-5-dimethoxysilylpentyl)urea
SMILESCO[SiH](OC)C(N)CCCCNC(N)=O
InChIInChI=1S/C8H21N3O3Si/c1-13-15(14-2)7(9)5-3-4-6-11-8(10)12/h7,15H,3-6,9H2,1-2H3,(H3,10,11,12)
InChIKeyKMBBKPFJMLMYLA-UHFFFAOYSA-N
XLogP-0.80
TPSA99.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.36
LogP ≤ 5-0.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

2-amino-6-(carbamoylamino)-N-methylhexanamide
CID 137464971
methyl (2S)-2-amino-6-(carbamothioylamino)hexanoate
CID 10420982
3-methoxypropylurea
CID 2064040
6-trimethoxysilylhexylurea
CID 87148927
4-(carbamoylamino)butoxy-dimethoxysulfanium
CID 151159357
(2S)-6-(carbamoylamino)-2-(methylamino)hexanoic acid
CID 87065655
12-hydroxydodecylurea
CID 57265418
(2R)-2-amino-5-(carbamoylamino)pentanamide
CID 129140717
(4-amino-5-oxohexyl)urea;ethane
CID 145237808
ethyl 2-amino-5-(carbamoylamino)pentanoate;hydrochloride
CID 74933713
pentylurea;hydrate
CID 172845599
[(4S)-4-amino-5-hydroxypentyl]urea
CID 122174122

Frequently Asked Questions

What is the IUPAC name of (5-amino-5-dimethoxysilylpentyl)urea?
The IUPAC name of (5-amino-5-dimethoxysilylpentyl)urea (CID 175187119) is (5-amino-5-dimethoxysilylpentyl)urea.
What is the SMILES notation for (5-amino-5-dimethoxysilylpentyl)urea?
The canonical SMILES for (5-amino-5-dimethoxysilylpentyl)urea is CO[SiH](OC)C(N)CCCCNC(N)=O.
What is the InChIKey of (5-amino-5-dimethoxysilylpentyl)urea?
The InChIKey is KMBBKPFJMLMYLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N3O3Si/c1-13-15(14-2)7(9)5-3-4-6-11-8(10)12/h7,15H,3-6,9H2,1-2H3,(H3,10,11,12).
What are the key properties of (5-amino-5-dimethoxysilylpentyl)urea?
(5-amino-5-dimethoxysilylpentyl)urea has a molecular weight of 235.36 g/mol, XLogP of -0.80, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-5-dimethoxysilylpentyl)urea is sourced from PubChem (CID 175187119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).