(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone

C18H32N4O2Si — CID 140876648

IUPAC(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone
SMILESCC(C)(C)[Si](C)(C)OCCN1CCN(C(=O)c2ccc(N)nc2)CC1
InChIInChI=1S/C18H32N4O2Si/c1-18(2,3)25(4,5)24-13-12-21-8-10-22(11-9-21)17(23)15-6-7-16(19)20-14-15/h6-7,14H,8-13H2,1-5H3,(H2,19,20)
InChIKeyGSWOEMHWNBZPEF-UHFFFAOYSA-N
MW364.57 g/mol
LogP2.44
Rot. Bonds5

About (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone

(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone (PubChem CID 140876648) has the molecular formula C18H32N4O2Si and a molecular weight of 364.57 g/mol. Its IUPAC name is (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone
PubChem CID140876648
Molecular FormulaC18H32N4O2Si
Molecular Weight364.57 g/mol
Exact Mass364.23
IUPAC Name(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone
SMILESCC(C)(C)[Si](C)(C)OCCN1CCN(C(=O)c2ccc(N)nc2)CC1
InChIInChI=1S/C18H32N4O2Si/c1-18(2,3)25(4,5)24-13-12-21-8-10-22(11-9-21)17(23)15-6-7-16(19)20-14-15/h6-7,14H,8-13H2,1-5H3,(H2,19,20)
InChIKeyGSWOEMHWNBZPEF-UHFFFAOYSA-N
XLogP2.44
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.57
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone with MolForge

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Related Compounds

4-(6-aminopyridine-3-carbonyl)piperazine-1-carboxylic acid
CID 86641079
1-(6-amino-3-pyridinyl)azepan-2-one;4-(6-amino-3-pyridinyl)-1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,4-diazepan-5-one
CID 157313113
2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide
CID 72857433
(6-amino-3-pyridinyl)-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methanone
CID 110854155
[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 31112745
(6-amino-3-pyridinyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 68729434
[4-(6-aminopyridine-3-carbonyl)-1,4-diazepan-1-yl]-(2-methoxy-4-pyridinyl)methanone
CID 134700221
(6-amino-3-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone
CID 63162100
[4-[(2S)-2-hydroxy-3,3-dimethylbutyl]piperazin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 95342710
[6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-3-pyridinyl]-[4-(2-phenylethyl)piperazin-1-yl]methanone
CID 91625393
[4-(2-methoxyethyl)piperazin-1-yl]-[2-(propan-2-ylamino)pyrimidin-5-yl]methanone
CID 72900903
6-aminopyridine-3-carboxylic acid;ethane
CID 142242146

Frequently Asked Questions

What is the IUPAC name of (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone?
The IUPAC name of (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone (CID 140876648) is (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone.
What is the SMILES notation for (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone?
The canonical SMILES for (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone is CC(C)(C)[Si](C)(C)OCCN1CCN(C(=O)c2ccc(N)nc2)CC1.
What is the InChIKey of (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone?
The InChIKey is GSWOEMHWNBZPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O2Si/c1-18(2,3)25(4,5)24-13-12-21-8-10-22(11-9-21)17(23)15-6-7-16(19)20-14-15/h6-7,14H,8-13H2,1-5H3,(H2,19,20).
What are the key properties of (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone?
(6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone has a molecular weight of 364.57 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-3-pyridinyl)-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperazin-1-yl]methanone is sourced from PubChem (CID 140876648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).