N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide

C17H30N2OSi — CID 103438042

IUPACN-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide
SMILESCC(NCc1ccc([Si](C)(C)C)cc1)C(=O)NC(C)(C)C
InChIInChI=1S/C17H30N2OSi/c1-13(16(20)19-17(2,3)4)18-12-14-8-10-15(11-9-14)21(5,6)7/h8-11,13,18H,12H2,1-7H3,(H,19,20)
InChIKeyZSEOJDGGPFORMF-UHFFFAOYSA-N
MW306.53 g/mol
LogP2.62
Rot. Bonds5

About N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide

N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide (PubChem CID 103438042) has the molecular formula C17H30N2OSi and a molecular weight of 306.53 g/mol. Its IUPAC name is N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide
PubChem CID103438042
Molecular FormulaC17H30N2OSi
Molecular Weight306.53 g/mol
Exact Mass306.21
IUPAC NameN-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide
SMILESCC(NCc1ccc([Si](C)(C)C)cc1)C(=O)NC(C)(C)C
InChIInChI=1S/C17H30N2OSi/c1-13(16(20)19-17(2,3)4)18-12-14-8-10-15(11-9-14)21(5,6)7/h8-11,13,18H,12H2,1-7H3,(H,19,20)
InChIKeyZSEOJDGGPFORMF-UHFFFAOYSA-N
XLogP2.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.53
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-tert-butyl-2-[(4-methylphenyl)methylamino]propanamide
CID 43087569
2-[4-[[[1-(tert-butylamino)-1-oxopropan-2-yl]amino]methyl]phenyl]acetic acid
CID 103262777
N-tert-butyl-2-(pyrimidin-5-ylmethylamino)propanamide
CID 112688824
N-tert-butyl-2-[(3,4-dibromophenyl)methylamino]propanamide
CID 115693123
N-tert-butyl-2-[(4-propoxyphenyl)methylamino]propanamide
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N-tert-butyl-2-[(3,5-difluorophenyl)methylamino]propanamide
CID 115579695
2-[(5-bromothiophen-2-yl)methylamino]-N-tert-butylpropanamide
CID 47165182
N-tert-butyl-2-[[3-(methoxymethyl)phenyl]methylamino]propanamide
CID 61003389
2-[(4-tert-butylphenyl)methylamino]-N-propan-2-ylpropanamide
CID 115750730
N-tert-butyl-2-[(4-chlorothiophen-2-yl)methylamino]propanamide
CID 113406765
N-tert-butyl-2-[[3-ethoxy-4-(2,2,2-trifluoroethoxy)phenyl]methylamino]propanamide
CID 119106874

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide?
The IUPAC name of N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide (CID 103438042) is N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide.
What is the SMILES notation for N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide?
The canonical SMILES for N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide is CC(NCc1ccc([Si](C)(C)C)cc1)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide?
The InChIKey is ZSEOJDGGPFORMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2OSi/c1-13(16(20)19-17(2,3)4)18-12-14-8-10-15(11-9-14)21(5,6)7/h8-11,13,18H,12H2,1-7H3,(H,19,20).
What are the key properties of N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide?
N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide has a molecular weight of 306.53 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(4-trimethylsilylphenyl)methylamino]propanamide is sourced from PubChem (CID 103438042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).