trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane

C13H21N3OSi — CID 141189277

IUPACtrimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1ccc(-c2cn[nH]c2)c1
InChIInChI=1S/C13H21N3OSi/c1-18(2,3)7-6-17-11-16-5-4-12(10-16)13-8-14-15-9-13/h4-5,8-10H,6-7,11H2,1-3H3,(H,14,15)
InChIKeyNSPVPXYJTLBBHC-UHFFFAOYSA-N
MW263.42 g/mol
LogP3.19
Rot. Bonds6

About trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane

trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane (PubChem CID 141189277) has the molecular formula C13H21N3OSi and a molecular weight of 263.42 g/mol. Its IUPAC name is trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane
PubChem CID141189277
Molecular FormulaC13H21N3OSi
Molecular Weight263.42 g/mol
Exact Mass263.15
IUPAC Nametrimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1ccc(-c2cn[nH]c2)c1
InChIInChI=1S/C13H21N3OSi/c1-18(2,3)7-6-17-11-16-5-4-12(10-16)13-8-14-15-9-13/h4-5,8-10H,6-7,11H2,1-3H3,(H,14,15)
InChIKeyNSPVPXYJTLBBHC-UHFFFAOYSA-N
XLogP3.19
TPSA42.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[2-[[6-(1H-pyrazol-4-yl)pyrazolo[4,3-c]pyridin-1-yl]methoxy]ethyl]silane
CID 86707161
1-(2-trimethylsilylethoxymethyl)pyrrole-3-carbaldehyde
CID 91103274
2-[[3-(2-chloro-6-fluorophenyl)pyrrol-1-yl]methoxy]ethyl-trimethylsilane
CID 175454411
3-(4-fluorophenyl)-1-(2-trimethylsilylethoxymethyl)pyridin-4-one
CID 140735529
trimethyl-[2-[[4-methyl-2-[4-(1H-pyrazol-4-yl)-2-pyridinyl]imidazol-1-yl]methoxy]ethyl]silane;trimethyl-[2-[[5-methyl-2-[4-(1H-pyrazol-4-yl)-2-pyridinyl]imidazol-1-yl]methoxy]ethyl]silane
CID 161385712
1-(2-trimethylsilylethoxymethyl)imidazol-4-amine
CID 58367438
trimethyl-[2-[[5-(6-methyl-2-pyridinyl)-4-[3-(1H-pyrazol-4-yl)quinolin-6-yl]imidazol-1-yl]methoxy]ethyl]silane
CID 156686536
2-(imidazol-1-ylmethoxy)ethyl-trimethylsilane
CID 11052605
trimethyl-[2-[[4-(4-methylphenyl)triazol-1-yl]methoxy]ethyl]silane
CID 70911861
5-bromo-1H-imidazole;2-[(4-bromoimidazol-1-yl)methoxy]ethyl-trimethylsilane
CID 161078247
4-(1H-pyrazol-4-yl)-1H-pyrazole
CID 2422340
2-[(4-butylimidazol-1-yl)methoxy]ethyl-trimethylsilane
CID 71485604

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane (CID 141189277) is trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane is C[Si](C)(C)CCOCn1ccc(-c2cn[nH]c2)c1.
What is the InChIKey of trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane?
The InChIKey is NSPVPXYJTLBBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OSi/c1-18(2,3)7-6-17-11-16-5-4-12(10-16)13-8-14-15-9-13/h4-5,8-10H,6-7,11H2,1-3H3,(H,14,15).
What are the key properties of trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane?
trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane has a molecular weight of 263.42 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[3-(1H-pyrazol-4-yl)pyrrol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 141189277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).