N,N,3-trimethyl-2-silyloxynonadecan-4-amine

C22H49NOSi — CID 123751009

IUPACN,N,3-trimethyl-2-silyloxynonadecan-4-amine
SMILESCCCCCCCCCCCCCCCC(C(C)C(C)O[SiH3])N(C)C
InChIInChI=1S/C22H49NOSi/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(23(4)5)20(2)21(3)24-25/h20-22H,6-19H2,1-5,25H3
InChIKeyNGRAPHRPNNCRGQ-UHFFFAOYSA-N
MW371.73 g/mol
LogP5.72
Rot. Bonds18

About N,N,3-trimethyl-2-silyloxynonadecan-4-amine

N,N,3-trimethyl-2-silyloxynonadecan-4-amine (PubChem CID 123751009) has the molecular formula C22H49NOSi and a molecular weight of 371.73 g/mol. Its IUPAC name is N,N,3-trimethyl-2-silyloxynonadecan-4-amine.

Molecular Properties

Compound NameN,N,3-trimethyl-2-silyloxynonadecan-4-amine
PubChem CID123751009
Molecular FormulaC22H49NOSi
Molecular Weight371.73 g/mol
Exact Mass371.36
IUPAC NameN,N,3-trimethyl-2-silyloxynonadecan-4-amine
SMILESCCCCCCCCCCCCCCCC(C(C)C(C)O[SiH3])N(C)C
InChIInChI=1S/C22H49NOSi/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(23(4)5)20(2)21(3)24-25/h20-22H,6-19H2,1-5,25H3
InChIKeyNGRAPHRPNNCRGQ-UHFFFAOYSA-N
XLogP5.72
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.73
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

3-(dimethylamino)decan-2-ol
CID 87744632
tetradecan-2-yloxysilane
CID 173015270
3-[4-(dimethylamino)decan-3-yloxy]-N,N-dimethyldecan-4-amine
CID 87698192
3-[4-(dimethylamino)tetradecan-3-yloxy]-N,N-dimethyltetradecan-4-amine
CID 87698187
N,N-dimethylnonadecan-2-amine;hydrochloride
CID 175046684
N,N,4-trimethylnonan-3-amine
CID 123453361
2-methylnonadecoxysilane
CID 173152930
(10R)-N,N-dimethylheptacosan-10-amine
CID 134549801
N,N-dimethyltetracontan-19-amine
CID 45382230
N,N-dimethylpentadecan-8-amine;hydrobromide
CID 173437553
N,N-dimethylicosan-7-amine;hydrobromide
CID 173410689
N,N-dimethylicosan-5-amine
CID 19862397

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-2-silyloxynonadecan-4-amine?
The IUPAC name of N,N,3-trimethyl-2-silyloxynonadecan-4-amine (CID 123751009) is N,N,3-trimethyl-2-silyloxynonadecan-4-amine.
What is the SMILES notation for N,N,3-trimethyl-2-silyloxynonadecan-4-amine?
The canonical SMILES for N,N,3-trimethyl-2-silyloxynonadecan-4-amine is CCCCCCCCCCCCCCCC(C(C)C(C)O[SiH3])N(C)C.
What is the InChIKey of N,N,3-trimethyl-2-silyloxynonadecan-4-amine?
The InChIKey is NGRAPHRPNNCRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H49NOSi/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(23(4)5)20(2)21(3)24-25/h20-22H,6-19H2,1-5,25H3.
What are the key properties of N,N,3-trimethyl-2-silyloxynonadecan-4-amine?
N,N,3-trimethyl-2-silyloxynonadecan-4-amine has a molecular weight of 371.73 g/mol, XLogP of 5.72, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-2-silyloxynonadecan-4-amine is sourced from PubChem (CID 123751009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).