1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine

C16H29NOSi — CID 103437841

IUPAC1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine
SMILESCCCC(COC)NCc1ccc([Si](C)(C)C)cc1
InChIInChI=1S/C16H29NOSi/c1-6-7-15(13-18-2)17-12-14-8-10-16(11-9-14)19(3,4)5/h8-11,15,17H,6-7,12-13H2,1-5H3
InChIKeyZTOUWWHSYNHIPC-UHFFFAOYSA-N
MW279.50 g/mol
LogP3.14
Rot. Bonds8

About 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine

1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine (PubChem CID 103437841) has the molecular formula C16H29NOSi and a molecular weight of 279.50 g/mol. Its IUPAC name is 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine
PubChem CID103437841
Molecular FormulaC16H29NOSi
Molecular Weight279.50 g/mol
Exact Mass279.20
IUPAC Name1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine
SMILESCCCC(COC)NCc1ccc([Si](C)(C)C)cc1
InChIInChI=1S/C16H29NOSi/c1-6-7-15(13-18-2)17-12-14-8-10-16(11-9-14)19(3,4)5/h8-11,15,17H,6-7,12-13H2,1-5H3
InChIKeyZTOUWWHSYNHIPC-UHFFFAOYSA-N
XLogP3.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.50
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(4-trimethylsilylphenyl)methyl]hex-1-yn-3-amine
CID 114161247
(2S)-N-benzyl-1-methoxybutan-2-amine
CID 95366266
N-[(4-fluorophenyl)methyl]hexan-3-amine
CID 62118907
N-benzyl-4-chloro-1-methoxybutan-2-amine
CID 106152824
1-chloro-N-[(4-fluorophenyl)methyl]-3-methoxypropan-2-amine
CID 106180782
N-(1-benzofuran-3-ylmethyl)-1-methoxypentan-2-amine
CID 80702779
N-[(4-methylphenyl)methyl]hexan-3-amine
CID 62117408
N-[(4-fluorophenyl)methyl]octan-4-amine
CID 114138071
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-methoxypentan-2-amine
CID 79578579
3-chloro-2-[(1-methoxypentan-2-ylamino)methyl]phenol
CID 113276514
N-[(4-chlorophenyl)methyl]hexan-3-amine
CID 62118720
5-[(1-methoxypentan-2-ylamino)methyl]thiophene-3-carboxamide
CID 79613876

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine?
The IUPAC name of 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine (CID 103437841) is 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine.
What is the SMILES notation for 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine?
The canonical SMILES for 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine is CCCC(COC)NCc1ccc([Si](C)(C)C)cc1.
What is the InChIKey of 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine?
The InChIKey is ZTOUWWHSYNHIPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NOSi/c1-6-7-15(13-18-2)17-12-14-8-10-16(11-9-14)19(3,4)5/h8-11,15,17H,6-7,12-13H2,1-5H3.
What are the key properties of 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine?
1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine has a molecular weight of 279.50 g/mol, XLogP of 3.14, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-[(4-trimethylsilylphenyl)methyl]pentan-2-amine is sourced from PubChem (CID 103437841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).