(6-propan-2-yl-2-pyridinyl)methyl carbamate

C10H14N2O2 — CID 175093258

IUPAC(6-propan-2-yl-2-pyridinyl)methyl carbamate
SMILESCC(C)c1cccc(COC(N)=O)n1
InChIInChI=1S/C10H14N2O2/c1-7(2)9-5-3-4-8(12-9)6-14-10(11)13/h3-5,7H,6H2,1-2H3,(H2,11,13)
InChIKeyFGROJRNRJNKCCT-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.80
Rot. Bonds3

About (6-propan-2-yl-2-pyridinyl)methyl carbamate

(6-propan-2-yl-2-pyridinyl)methyl carbamate (PubChem CID 175093258) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (6-propan-2-yl-2-pyridinyl)methyl carbamate.

Molecular Properties

Compound Name(6-propan-2-yl-2-pyridinyl)methyl carbamate
PubChem CID175093258
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(6-propan-2-yl-2-pyridinyl)methyl carbamate
SMILESCC(C)c1cccc(COC(N)=O)n1
InChIInChI=1S/C10H14N2O2/c1-7(2)9-5-3-4-8(12-9)6-14-10(11)13/h3-5,7H,6H2,1-2H3,(H2,11,13)
InChIKeyFGROJRNRJNKCCT-UHFFFAOYSA-N
XLogP1.80
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6-propan-2-yl-2-pyridinyl)methanamine
CID 59570017
2-propan-2-yl-6-(2,2,2-trifluoroethoxymethyl)pyridine
CID 20709403
2-(6-propan-2-yl-2-pyridinyl)ethanol
CID 67800992
2-(6-propan-2-yl-2-pyridinyl)ethanamine
CID 20823809
[6-[(1R)-1-hydroxyethyl]-2-pyridinyl]methyl hexadecanoate
CID 10810490
bis(6-propan-2-yl-2-pyridinyl)methanone
CID 150446878
[6-(methylcarbamoyloxymethyl)-2-pyridinyl]methyl N-methylcarbamate
CID 4990
3-[6-(1-hydroxyethyl)-2-pyridinyl]-2,2-dimethylpropanamide
CID 69122207
O-[[6-(1-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine
CID 69456471
6-propan-2-ylpyridine-2-carbonyl chloride
CID 130153225
N-ethyl-N-[(6-propan-2-yl-2-pyridinyl)methyl]ethanamine
CID 138538363
2-methyl-6-propan-2-ylpyridine
CID 12791785

Frequently Asked Questions

What is the IUPAC name of (6-propan-2-yl-2-pyridinyl)methyl carbamate?
The IUPAC name of (6-propan-2-yl-2-pyridinyl)methyl carbamate (CID 175093258) is (6-propan-2-yl-2-pyridinyl)methyl carbamate.
What is the SMILES notation for (6-propan-2-yl-2-pyridinyl)methyl carbamate?
The canonical SMILES for (6-propan-2-yl-2-pyridinyl)methyl carbamate is CC(C)c1cccc(COC(N)=O)n1.
What is the InChIKey of (6-propan-2-yl-2-pyridinyl)methyl carbamate?
The InChIKey is FGROJRNRJNKCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7(2)9-5-3-4-8(12-9)6-14-10(11)13/h3-5,7H,6H2,1-2H3,(H2,11,13).
What are the key properties of (6-propan-2-yl-2-pyridinyl)methyl carbamate?
(6-propan-2-yl-2-pyridinyl)methyl carbamate has a molecular weight of 194.23 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-propan-2-yl-2-pyridinyl)methyl carbamate is sourced from PubChem (CID 175093258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).