(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine

C22H35NO2Si — CID 70803793

IUPAC(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine
SMILESCC[C@@H](N[C@@H](CO[Si](C)(C)C)c1ccccc1)c1cc(C(C)C)c(C)o1
InChIInChI=1S/C22H35NO2Si/c1-8-20(22-14-19(16(2)3)17(4)25-22)23-21(15-24-26(5,6)7)18-12-10-9-11-13-18/h9-14,16,20-21,23H,8,15H2,1-7H3/t20-,21+/m1/s1
InChIKeyTWOZXJZMXHAAMK-RTWAWAEBSA-N
MW373.61 g/mol
LogP6.34
Rot. Bonds9

About (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine

(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine (PubChem CID 70803793) has the molecular formula C22H35NO2Si and a molecular weight of 373.61 g/mol. Its IUPAC name is (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine.

Molecular Properties

Compound Name(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine
PubChem CID70803793
Molecular FormulaC22H35NO2Si
Molecular Weight373.61 g/mol
Exact Mass373.24
IUPAC Name(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine
SMILESCC[C@@H](N[C@@H](CO[Si](C)(C)C)c1ccccc1)c1cc(C(C)C)c(C)o1
InChIInChI=1S/C22H35NO2Si/c1-8-20(22-14-19(16(2)3)17(4)25-22)23-21(15-24-26(5,6)7)18-12-10-9-11-13-18/h9-14,16,20-21,23H,8,15H2,1-7H3/t20-,21+/m1/s1
InChIKeyTWOZXJZMXHAAMK-RTWAWAEBSA-N
XLogP6.34
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.61
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-phenyl-2-trimethylsilyloxyethyl)-1-[4-(trifluoromethyl)phenyl]propan-1-amine
CID 155890138
(2R)-2-[[(1R)-1-(4-bromo-5-methylfuran-2-yl)propyl]amino]-2-phenylethanol
CID 59664765
2-[[(1R)-1-(5-methylfuran-2-yl)propyl]amino]-2-phenylethanol
CID 67128601
(1S)-1-phenyl-N-propan-2-ylpropan-1-amine
CID 14387504
1-phenyl-N-[(1S)-1-phenylethyl]propan-1-amine
CID 78956018
1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1S)-1-phenylpropyl]methanimine
CID 58104667
(2R)-3-methyl-N-[(1R)-1-phenylpropyl]butan-2-amine
CID 29012459
1-phenyl-N-[1-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 43712916
(2R)-2-[1-(2,5-dimethylfuran-3-yl)ethylamino]-2-phenylethanol
CID 107093791
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-1-phenylpropan-1-amine
CID 43724000
1-(4-methylphenyl)-N-[(1R)-1-phenylethyl]propan-1-amine
CID 81351883
2-methoxy-N-[(1R)-1-(3-methylphenyl)ethyl]-1-phenylethanamine
CID 103464451

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine?
The IUPAC name of (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine (CID 70803793) is (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine.
What is the SMILES notation for (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine?
The canonical SMILES for (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine is CC[C@@H](N[C@@H](CO[Si](C)(C)C)c1ccccc1)c1cc(C(C)C)c(C)o1.
What is the InChIKey of (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine?
The InChIKey is TWOZXJZMXHAAMK-RTWAWAEBSA-N. The full InChI is InChI=1S/C22H35NO2Si/c1-8-20(22-14-19(16(2)3)17(4)25-22)23-21(15-24-26(5,6)7)18-12-10-9-11-13-18/h9-14,16,20-21,23H,8,15H2,1-7H3/t20-,21+/m1/s1.
What are the key properties of (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine?
(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine has a molecular weight of 373.61 g/mol, XLogP of 6.34, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)-N-[(1R)-1-phenyl-2-trimethylsilyloxyethyl]propan-1-amine is sourced from PubChem (CID 70803793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).