1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine

C9H21NO3Si — CID 175135496

IUPAC1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine
SMILESCCC(N)C1CCC[Si](OC)(OC)O1
InChIInChI=1S/C9H21NO3Si/c1-4-8(10)9-6-5-7-14(11-2,12-3)13-9/h8-9H,4-7,10H2,1-3H3
InChIKeyFORWJPHOUALAMN-UHFFFAOYSA-N
MW219.36 g/mol
LogP1.13
Rot. Bonds4

About 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine

1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine (PubChem CID 175135496) has the molecular formula C9H21NO3Si and a molecular weight of 219.36 g/mol. Its IUPAC name is 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine.

Molecular Properties

Compound Name1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine
PubChem CID175135496
Molecular FormulaC9H21NO3Si
Molecular Weight219.36 g/mol
Exact Mass219.13
IUPAC Name1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine
SMILESCCC(N)C1CCC[Si](OC)(OC)O1
InChIInChI=1S/C9H21NO3Si/c1-4-8(10)9-6-5-7-14(11-2,12-3)13-9/h8-9H,4-7,10H2,1-3H3
InChIKeyFORWJPHOUALAMN-UHFFFAOYSA-N
XLogP1.13
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.36
LogP ≤ 51.13
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

1-(2,2-dimethyloxasilinan-6-yl)propane-1-thiol
CID 88829184
1-N'-[1-(2,2-dimethyloxasilinan-6-yl)propyl]ethane-1,1-diamine
CID 66958834
1-N'-[1-(2,2,3,3-tetramethoxyoxadisilinan-6-yl)propyl]ethane-1,1-diamine
CID 174976255
1-(2,2,6-trimethoxyoxasilinan-6-yl)propane-1-thiol
CID 88621639
(1R)-1-[(3S)-oxan-3-yl]propan-1-amine
CID 96636720
4-(2,2-diethoxyoxasilinan-6-yl)butan-1-amine
CID 67391709
1-(2-methylcyclohexyl)propan-1-amine
CID 79307565
1-[4-(4-methoxycyclohexyl)cyclohexyl]propan-1-amine
CID 126539680
2-amino-2-(oxolan-2-yl)ethanol;hydrochloride
CID 69084455
1-(4-oxidomorpholin-4-ium-2-yl)propan-1-amine
CID 87316910
(1S)-1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl)propan-1-amine
CID 104932294
1-(3,5-dimethylcycloheptyl)propan-1-amine
CID 145017744

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine?
The IUPAC name of 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine (CID 175135496) is 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine.
What is the SMILES notation for 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine?
The canonical SMILES for 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine is CCC(N)C1CCC[Si](OC)(OC)O1.
What is the InChIKey of 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine?
The InChIKey is FORWJPHOUALAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO3Si/c1-4-8(10)9-6-5-7-14(11-2,12-3)13-9/h8-9H,4-7,10H2,1-3H3.
What are the key properties of 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine?
1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine has a molecular weight of 219.36 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethoxyoxasilinan-6-yl)propan-1-amine is sourced from PubChem (CID 175135496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).