N-(3-trimethoxysilylpropyl)carbamate

C7H16NO5Si- — CID 19019611

IUPACN-(3-trimethoxysilylpropyl)carbamate
SMILESCO[Si](CCCNC(=O)[O-])(OC)OC
InChIInChI=1S/C7H17NO5Si/c1-11-14(12-2,13-3)6-4-5-8-7(9)10/h8H,4-6H2,1-3H3,(H,9,10)/p-1
InChIKeyOKVHMJBNYSHURR-UHFFFAOYSA-M
MW222.29 g/mol
LogP-0.81
Rot. Bonds7

About N-(3-trimethoxysilylpropyl)carbamate

N-(3-trimethoxysilylpropyl)carbamate (PubChem CID 19019611) has the molecular formula C7H16NO5Si- and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(3-trimethoxysilylpropyl)carbamate.

Molecular Properties

Compound NameN-(3-trimethoxysilylpropyl)carbamate
PubChem CID19019611
Molecular FormulaC7H16NO5Si-
Molecular Weight222.29 g/mol
Exact Mass222.08
IUPAC NameN-(3-trimethoxysilylpropyl)carbamate
SMILESCO[Si](CCCNC(=O)[O-])(OC)OC
InChIInChI=1S/C7H17NO5Si/c1-11-14(12-2,13-3)6-4-5-8-7(9)10/h8H,4-6H2,1-3H3,(H,9,10)/p-1
InChIKeyOKVHMJBNYSHURR-UHFFFAOYSA-M
XLogP-0.81
TPSA79.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 5-0.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

N,N'-bis(3-trimethoxysilylpropyl)oxamide
CID 122383973
2-methoxy-N-(3-trimethoxysilylpropyl)acetamide
CID 102479159
4-trimethoxysilylbutylcarbamic acid
CID 18755644
1-[2-(methylamino)ethyl]-3-(3-trimethoxysilylpropyl)urea
CID 58846540
3-(3-trimethoxysilylpropyl)-1,1-bis[2-(3-trimethoxysilylpropylcarbamoylamino)ethyl]urea
CID 20743189
2-acetamido-N-(3-trimethoxysilylpropyl)acetamide
CID 87064791
2-methylsulfonyl-N-(3-trimethoxysilylpropyl)acetamide
CID 140721019
propan-2-one;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 175097855
6-trimethoxysilylhexylurea
CID 87148927
N-(3-trimethoxysilylpropyl)tricosanamide
CID 175992989
N-(3-trimethoxysilylpropyl)octanamide
CID 71362207
prop-2-enyl N-(3-trimethoxysilylpropyl)carbamate
CID 18672768

Frequently Asked Questions

What is the IUPAC name of N-(3-trimethoxysilylpropyl)carbamate?
The IUPAC name of N-(3-trimethoxysilylpropyl)carbamate (CID 19019611) is N-(3-trimethoxysilylpropyl)carbamate.
What is the SMILES notation for N-(3-trimethoxysilylpropyl)carbamate?
The canonical SMILES for N-(3-trimethoxysilylpropyl)carbamate is CO[Si](CCCNC(=O)[O-])(OC)OC.
What is the InChIKey of N-(3-trimethoxysilylpropyl)carbamate?
The InChIKey is OKVHMJBNYSHURR-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H17NO5Si/c1-11-14(12-2,13-3)6-4-5-8-7(9)10/h8H,4-6H2,1-3H3,(H,9,10)/p-1.
What are the key properties of N-(3-trimethoxysilylpropyl)carbamate?
N-(3-trimethoxysilylpropyl)carbamate has a molecular weight of 222.29 g/mol, XLogP of -0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-trimethoxysilylpropyl)carbamate is sourced from PubChem (CID 19019611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).