N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine

C35H69NO3Si — CID 164755016

IUPACN,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine
SMILESCCCCC/C=C\CCCO[Si](CCCN(C)C)(OCCC/C=C\CCCCC)OCCC/C=C\CCCCC
InChIInChI=1S/C35H69NO3Si/c1-6-9-12-15-18-21-24-27-32-37-40(35-30-31-36(4)5,38-33-28-25-22-19-16-13-10-7-2)39-34-29-26-23-20-17-14-11-8-3/h18-23H,6-17,24-35H2,1-5H3/b21-18-,22-19-,23-20-
InChIKeyMEDOUGVDSMUXHB-ASSJVFBPSA-N
MW580.03 g/mol
LogP10.68
Rot. Bonds31

About N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine

N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine (PubChem CID 164755016) has the molecular formula C35H69NO3Si and a molecular weight of 580.03 g/mol. Its IUPAC name is N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine
PubChem CID164755016
Molecular FormulaC35H69NO3Si
Molecular Weight580.03 g/mol
Exact Mass579.50
IUPAC NameN,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine
SMILESCCCCC/C=C\CCCO[Si](CCCN(C)C)(OCCC/C=C\CCCCC)OCCC/C=C\CCCCC
InChIInChI=1S/C35H69NO3Si/c1-6-9-12-15-18-21-24-27-32-37-40(35-30-31-36(4)5,38-33-28-25-22-19-16-13-10-7-2)39-34-29-26-23-20-17-14-11-8-3/h18-23H,6-17,24-35H2,1-5H3/b21-18-,22-19-,23-20-
InChIKeyMEDOUGVDSMUXHB-ASSJVFBPSA-N
XLogP10.68
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds31
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500580.03
LogP ≤ 510.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-bromobutyl-tris[(Z)-dec-4-enoxy]silane
CID 156830018
N,N-dimethylhexadec-7-en-1-amine
CID 3085374
(E)-N,N-dimethylhexadec-10-en-1-amine
CID 102116363
(Z)-N,N-dimethylhenicos-12-en-1-amine
CID 173308130
(E)-N,N-dimethylnon-3-en-1-amine
CID 13212920
N,N-dimethylheptadec-3-en-1-amine;hydrochloride
CID 173393546
N,N,N'-trimethyl-N'-[(Z)-octadec-9-enyl]propane-1,3-diamine
CID 6437658
N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-(3-triethoxysilylpropyl)propane-1,3-diamine
CID 140647406
N,N-dimethylpropan-1-amine;(Z)-octadec-9-en-1-amine
CID 174780488
(9Z,12Z)-N-[4-(dimethylamino)butoxy]-N-[(9Z,12Z)-octadeca-9,12-dienyl]octadeca-9,12-dien-1-amine
CID 139508900
N,N-dimethyl-N'-[(9Z,12Z)-octadeca-9,12-dienoxy]-N'-[(9Z,12Z)-octadeca-9,12-dienyl]butane-1,4-diamine
CID 139508918
3-[3-[3-[3-(dimethylamino)propoxy-diethoxysilyl]propyltetrasulfanyl]propyl-diethoxysilyl]oxy-N,N-dimethylpropan-1-amine
CID 87342465

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine?
The IUPAC name of N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine (CID 164755016) is N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine?
The canonical SMILES for N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine is CCCCC/C=C\CCCO[Si](CCCN(C)C)(OCCC/C=C\CCCCC)OCCC/C=C\CCCCC.
What is the InChIKey of N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine?
The InChIKey is MEDOUGVDSMUXHB-ASSJVFBPSA-N. The full InChI is InChI=1S/C35H69NO3Si/c1-6-9-12-15-18-21-24-27-32-37-40(35-30-31-36(4)5,38-33-28-25-22-19-16-13-10-7-2)39-34-29-26-23-20-17-14-11-8-3/h18-23H,6-17,24-35H2,1-5H3/b21-18-,22-19-,23-20-.
What are the key properties of N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine?
N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine has a molecular weight of 580.03 g/mol, XLogP of 10.68, 31 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-tris[(Z)-dec-4-enoxy]silylpropan-1-amine is sourced from PubChem (CID 164755016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).