methyl N-(3-diethoxysilylpentyl)carbamate

C11H25NO4Si — CID 154173330

IUPACmethyl N-(3-diethoxysilylpentyl)carbamate
SMILESCCO[SiH](OCC)C(CC)CCNC(=O)OC
InChIInChI=1S/C11H25NO4Si/c1-5-10(8-9-12-11(13)14-4)17(15-6-2)16-7-3/h10,17H,5-9H2,1-4H3,(H,12,13)
InChIKeyNYIZYVHOZHKQHD-UHFFFAOYSA-N
MW263.41 g/mol
LogP1.81
Rot. Bonds9

About methyl N-(3-diethoxysilylpentyl)carbamate

methyl N-(3-diethoxysilylpentyl)carbamate (PubChem CID 154173330) has the molecular formula C11H25NO4Si and a molecular weight of 263.41 g/mol. Its IUPAC name is methyl N-(3-diethoxysilylpentyl)carbamate.

Molecular Properties

Compound Namemethyl N-(3-diethoxysilylpentyl)carbamate
PubChem CID154173330
Molecular FormulaC11H25NO4Si
Molecular Weight263.41 g/mol
Exact Mass263.16
IUPAC Namemethyl N-(3-diethoxysilylpentyl)carbamate
SMILESCCO[SiH](OCC)C(CC)CCNC(=O)OC
InChIInChI=1S/C11H25NO4Si/c1-5-10(8-9-12-11(13)14-4)17(15-6-2)16-7-3/h10,17H,5-9H2,1-4H3,(H,12,13)
InChIKeyNYIZYVHOZHKQHD-UHFFFAOYSA-N
XLogP1.81
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl N-(4-diethoxysilylhexyl)carbamate
CID 154100096
ethyl N-(5-diethoxysilylheptyl)carbamate
CID 154096304
4-diethoxysilylhexyl(methyl)carbamic acid
CID 173191134
methyl N-(4-methylhexyl)carbamate
CID 126664152
4-(methoxycarbonylamino)-2-methylbutanoic acid
CID 80540364
5-diethoxysilylheptan-1-amine
CID 154490581
methyl N-[4-(methoxycarbonylamino)butyl]carbamate
CID 2255932
methyl N-[10-(methoxycarbonylamino)decyl]carbamate
CID 54285968
methyl N-(2-aminoethyl)carbamate;propane
CID 160898455
methyl N-[2-(propanoylamino)ethyl]carbamate
CID 108574125
methyl N-[3-(butan-2-ylamino)-3-oxopropyl]carbamate
CID 115590026
ethyl N-(2-diethoxysilylpropyl)carbamate
CID 154255932

Frequently Asked Questions

What is the IUPAC name of methyl N-(3-diethoxysilylpentyl)carbamate?
The IUPAC name of methyl N-(3-diethoxysilylpentyl)carbamate (CID 154173330) is methyl N-(3-diethoxysilylpentyl)carbamate.
What is the SMILES notation for methyl N-(3-diethoxysilylpentyl)carbamate?
The canonical SMILES for methyl N-(3-diethoxysilylpentyl)carbamate is CCO[SiH](OCC)C(CC)CCNC(=O)OC.
What is the InChIKey of methyl N-(3-diethoxysilylpentyl)carbamate?
The InChIKey is NYIZYVHOZHKQHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO4Si/c1-5-10(8-9-12-11(13)14-4)17(15-6-2)16-7-3/h10,17H,5-9H2,1-4H3,(H,12,13).
What are the key properties of methyl N-(3-diethoxysilylpentyl)carbamate?
methyl N-(3-diethoxysilylpentyl)carbamate has a molecular weight of 263.41 g/mol, XLogP of 1.81, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(3-diethoxysilylpentyl)carbamate is sourced from PubChem (CID 154173330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).