(6-tert-butyl-3-pyridinyl) carbamate

C10H14N2O2 — CID 175536069

IUPAC(6-tert-butyl-3-pyridinyl) carbamate
SMILESCC(C)(C)c1ccc(OC(N)=O)cn1
InChIInChI=1S/C10H14N2O2/c1-10(2,3)8-5-4-7(6-12-8)14-9(11)13/h4-6H,1-3H3,(H2,11,13)
InChIKeyKQQQIDVLBSXQMP-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.84
Rot. Bonds1

About (6-tert-butyl-3-pyridinyl) carbamate

(6-tert-butyl-3-pyridinyl) carbamate (PubChem CID 175536069) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (6-tert-butyl-3-pyridinyl) carbamate.

Molecular Properties

Compound Name(6-tert-butyl-3-pyridinyl) carbamate
PubChem CID175536069
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(6-tert-butyl-3-pyridinyl) carbamate
SMILESCC(C)(C)c1ccc(OC(N)=O)cn1
InChIInChI=1S/C10H14N2O2/c1-10(2,3)8-5-4-7(6-12-8)14-9(11)13/h4-6H,1-3H3,(H2,11,13)
InChIKeyKQQQIDVLBSXQMP-UHFFFAOYSA-N
XLogP1.84
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(trifluoromethyl)-3-pyridinyl] carbamate
CID 69179111
(6-tert-butyl-3-pyridinyl) azetidine-1-carboxylate
CID 175498808
6-tert-butylpyridine-3-carboxamide;ethane
CID 144695705
[6-(2-methyl-2-pyridin-2-ylpropanoyl)-3-pyridinyl] carbamate
CID 175276482
(6-formyl-3-pyridinyl) carbamate
CID 175352673
[6-(dimethylcarbamoyl)-3-pyridinyl] carbamate
CID 150452419
[6-(2-methylphenyl)-3-pyridinyl] carbamate
CID 175536018
trans-(1S,2S)-2-(6-tert-butyl-3-pyridinyl)cyclopropane-1-carboxamide
CID 126601635
[6-(2-methylsulfonylethyl)-3-pyridinyl] carbamate
CID 175000782
[6-[2-methyl-2-(1-methylpyrazol-4-yl)propanoyl]-3-pyridinyl] carbamate
CID 175276491
1-[(6-tert-butyl-3-pyridinyl)oxymethyl]cyclopropan-1-amine
CID 134595533
2-(5-methoxy-2-pyridinyl)-2-methylpropanoic acid
CID 86277143

Frequently Asked Questions

What is the IUPAC name of (6-tert-butyl-3-pyridinyl) carbamate?
The IUPAC name of (6-tert-butyl-3-pyridinyl) carbamate (CID 175536069) is (6-tert-butyl-3-pyridinyl) carbamate.
What is the SMILES notation for (6-tert-butyl-3-pyridinyl) carbamate?
The canonical SMILES for (6-tert-butyl-3-pyridinyl) carbamate is CC(C)(C)c1ccc(OC(N)=O)cn1.
What is the InChIKey of (6-tert-butyl-3-pyridinyl) carbamate?
The InChIKey is KQQQIDVLBSXQMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-10(2,3)8-5-4-7(6-12-8)14-9(11)13/h4-6H,1-3H3,(H2,11,13).
What are the key properties of (6-tert-butyl-3-pyridinyl) carbamate?
(6-tert-butyl-3-pyridinyl) carbamate has a molecular weight of 194.23 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-tert-butyl-3-pyridinyl) carbamate is sourced from PubChem (CID 175536069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).