N-propyl-N-triethoxysilylbutan-1-amine

C13H31NO3Si — CID 175342889

IUPACN-propyl-N-triethoxysilylbutan-1-amine
SMILESCCCCN(CCC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C13H31NO3Si/c1-6-11-13-14(12-7-2)18(15-8-3,16-9-4)17-10-5/h6-13H2,1-5H3
InChIKeyYDNWUDDZJJNNLV-UHFFFAOYSA-N
MW277.48 g/mol
LogP3.04
Rot. Bonds12

About N-propyl-N-triethoxysilylbutan-1-amine

N-propyl-N-triethoxysilylbutan-1-amine (PubChem CID 175342889) has the molecular formula C13H31NO3Si and a molecular weight of 277.48 g/mol. Its IUPAC name is N-propyl-N-triethoxysilylbutan-1-amine.

Molecular Properties

Compound NameN-propyl-N-triethoxysilylbutan-1-amine
PubChem CID175342889
Molecular FormulaC13H31NO3Si
Molecular Weight277.48 g/mol
Exact Mass277.21
IUPAC NameN-propyl-N-triethoxysilylbutan-1-amine
SMILESCCCCN(CCC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C13H31NO3Si/c1-6-11-13-14(12-7-2)18(15-8-3,16-9-4)17-10-5/h6-13H2,1-5H3
InChIKeyYDNWUDDZJJNNLV-UHFFFAOYSA-N
XLogP3.04
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.48
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-propyl-N-triethoxysilylbutan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine
CID 87547282
N-propyl-N-trimethoxysilyloctadecan-1-amine;hydrochloride
CID 173034322
N-ethyl-N-triethoxysilylethanamine
CID 14150693
N-propyl-3-triethoxysilyl-N-trimethylsilylpropan-1-amine
CID 90265370
(Z)-N-propyl-N-trimethoxysilyloctadec-9-en-1-amine;hydrochloride
CID 173241581
N-butyl-N-[dichloro-(dibutylamino)silyl]butan-1-amine
CID 13133738
N-methyl-N-triethoxysilylmethanamine;hydrate
CID 172845876
ethyl N-propyl-N-triethoxysilylcarbamate
CID 54468213
3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
CID 87204397
N,N-bis[(dipropylamino)-di(propan-2-yl)silyl]butan-1-amine
CID 156755995
N,N-dibutyl-8-[[8-(dibutylamino)octyl-diethoxysilyl]oxy-diethoxysilyl]octan-1-amine
CID 171623492
N-[(dipentylamino)-dimethoxysilyl]-N-pentylpentan-1-amine
CID 139816210

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-triethoxysilylbutan-1-amine?
The IUPAC name of N-propyl-N-triethoxysilylbutan-1-amine (CID 175342889) is N-propyl-N-triethoxysilylbutan-1-amine.
What is the SMILES notation for N-propyl-N-triethoxysilylbutan-1-amine?
The canonical SMILES for N-propyl-N-triethoxysilylbutan-1-amine is CCCCN(CCC)[Si](OCC)(OCC)OCC.
What is the InChIKey of N-propyl-N-triethoxysilylbutan-1-amine?
The InChIKey is YDNWUDDZJJNNLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NO3Si/c1-6-11-13-14(12-7-2)18(15-8-3,16-9-4)17-10-5/h6-13H2,1-5H3.
What are the key properties of N-propyl-N-triethoxysilylbutan-1-amine?
N-propyl-N-triethoxysilylbutan-1-amine has a molecular weight of 277.48 g/mol, XLogP of 3.04, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-triethoxysilylbutan-1-amine is sourced from PubChem (CID 175342889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).