[6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid

C18H31N3O3Si — CID 174107198

IUPAC[6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid
SMILESCC(C)(C)[Si](C)(C)OCC1CCN(c2ccc(NC(=O)O)cn2)CC1
InChIInChI=1S/C18H31N3O3Si/c1-18(2,3)25(4,5)24-13-14-8-10-21(11-9-14)16-7-6-15(12-19-16)20-17(22)23/h6-7,12,14,20H,8-11,13H2,1-5H3,(H,22,23)
InChIKeyODONMTMYWLPHTA-UHFFFAOYSA-N
MW365.55 g/mol
LogP4.41
Rot. Bonds5

About [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid

[6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid (PubChem CID 174107198) has the molecular formula C18H31N3O3Si and a molecular weight of 365.55 g/mol. Its IUPAC name is [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid.

Molecular Properties

Compound Name[6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid
PubChem CID174107198
Molecular FormulaC18H31N3O3Si
Molecular Weight365.55 g/mol
Exact Mass365.21
IUPAC Name[6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid
SMILESCC(C)(C)[Si](C)(C)OCC1CCN(c2ccc(NC(=O)O)cn2)CC1
InChIInChI=1S/C18H31N3O3Si/c1-18(2,3)25(4,5)24-13-14-8-10-21(11-9-14)16-7-6-15(12-19-16)20-17(22)23/h6-7,12,14,20H,8-11,13H2,1-5H3,(H,22,23)
InChIKeyODONMTMYWLPHTA-UHFFFAOYSA-N
XLogP4.41
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.55
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol
CID 86730059
N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]cyclopropanecarboxamide
CID 113015446
2-methyl-N-[[1-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]propan-2-amine
CID 62593015
2-amino-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]acetamide
CID 39181827
tert-butyl N-[6-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidin-1-yl]-2-fluoro-3-pyridinyl]carbamate
CID 46318074
3-[[1-[5-[(2-benzylbenzoyl)amino]-2-pyridinyl]piperidin-4-yl]methoxy]benzoic acid
CID 56839514
2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397
[6-(2-methylpyrrolidin-1-yl)-3-pyridinyl]carbamic acid
CID 170319554
2,2-dimethyl-4-oxo-4-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butanoic acid
CID 65302404
3-[[1-[5-(2,1-benzoxazole-3-carbonylamino)-2-pyridinyl]piperidin-4-yl]methoxy]benzoic acid
CID 56839511
N-[6-(azepan-1-yl)-3-pyridinyl]-2,2-dimethylpropanamide
CID 113015875
tert-butyl N-[6-(azepan-1-yl)-3-pyridinyl]carbamate
CID 113015925

Frequently Asked Questions

What is the IUPAC name of [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid?
The IUPAC name of [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid (CID 174107198) is [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid.
What is the SMILES notation for [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid?
The canonical SMILES for [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid is CC(C)(C)[Si](C)(C)OCC1CCN(c2ccc(NC(=O)O)cn2)CC1.
What is the InChIKey of [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid?
The InChIKey is ODONMTMYWLPHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O3Si/c1-18(2,3)25(4,5)24-13-14-8-10-21(11-9-14)16-7-6-15(12-19-16)20-17(22)23/h6-7,12,14,20H,8-11,13H2,1-5H3,(H,22,23).
What are the key properties of [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid?
[6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid has a molecular weight of 365.55 g/mol, XLogP of 4.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-1-yl]-3-pyridinyl]carbamic acid is sourced from PubChem (CID 174107198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).