N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine

C20H31NO2Si — CID 91698910

IUPACN-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine
SMILESCC(C)N(C)CC(COc1cccc2ccccc12)O[Si](C)(C)C
InChIInChI=1S/C20H31NO2Si/c1-16(2)21(3)14-18(23-24(4,5)6)15-22-20-13-9-11-17-10-7-8-12-19(17)20/h7-13,16,18H,14-15H2,1-6H3
InChIKeyUSXMPUIOKVEBIP-UHFFFAOYSA-N
MW345.56 g/mol
LogP4.78
Rot. Bonds8

About N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine

N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine (PubChem CID 91698910) has the molecular formula C20H31NO2Si and a molecular weight of 345.56 g/mol. Its IUPAC name is N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine.

Molecular Properties

Compound NameN-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine
PubChem CID91698910
Molecular FormulaC20H31NO2Si
Molecular Weight345.56 g/mol
Exact Mass345.21
IUPAC NameN-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine
SMILESCC(C)N(C)CC(COc1cccc2ccccc12)O[Si](C)(C)C
InChIInChI=1S/C20H31NO2Si/c1-16(2)21(3)14-18(23-24(4,5)6)15-22-20-13-9-11-17-10-7-8-12-19(17)20/h7-13,16,18H,14-15H2,1-6H3
InChIKeyUSXMPUIOKVEBIP-UHFFFAOYSA-N
XLogP4.78
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.56
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(1-naphthalen-1-yloxypropan-2-yloxy)naphthalene
CID 67649919
1-[(2R)-3-bromo-2-methoxypropoxy]naphthalene
CID 129405594
1-(4-methylpentoxy)naphthalene
CID 83168126
[(2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] acetate
CID 11077480
2-hydroperoxy-3-naphthalen-1-yloxy-N-propan-2-ylpropan-1-amine;hydrochloride
CID 90469824
[(2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] hydrogen sulfate
CID 14647133
2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)-propan-2-ylamino]acetonitrile
CID 110929469
(1-hydroxy-2-naphthalen-1-yloxyethyl)-propan-2-ylazanium chloride
CID 18529256
lithium;1-ethoxynaphthalene;hydride
CID 174613942
1-[2,2-diethoxyethyl(propan-2-yl)amino]-3-naphthalen-1-yloxypropan-2-ol
CID 21416658
(2S)-1-[2-methylsulfanylethyl(propan-2-yl)amino]-3-naphthalen-1-yloxypropan-2-ol
CID 54556253
2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)-methylamino]acetonitrile
CID 110929665

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine?
The IUPAC name of N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine (CID 91698910) is N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine.
What is the SMILES notation for N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine?
The canonical SMILES for N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine is CC(C)N(C)CC(COc1cccc2ccccc12)O[Si](C)(C)C.
What is the InChIKey of N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine?
The InChIKey is USXMPUIOKVEBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31NO2Si/c1-16(2)21(3)14-18(23-24(4,5)6)15-22-20-13-9-11-17-10-7-8-12-19(17)20/h7-13,16,18H,14-15H2,1-6H3.
What are the key properties of N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine?
N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine has a molecular weight of 345.56 g/mol, XLogP of 4.78, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine is sourced from PubChem (CID 91698910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).