(4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate

C15H16N2O2 — CID 142667852

IUPAC(4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate
SMILESCc1cc(C)nc(OC(=O)N(C)c2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c1-11-9-12(2)16-14(10-11)19-15(18)17(3)13-7-5-4-6-8-13/h4-10H,1-3H3
InChIKeyVEHRHQWFZNXKEY-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.33
Rot. Bonds2

About (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate

(4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate (PubChem CID 142667852) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate.

Molecular Properties

Compound Name(4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate
PubChem CID142667852
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name(4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate
SMILESCc1cc(C)nc(OC(=O)N(C)c2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c1-11-9-12(2)16-14(10-11)19-15(18)17(3)13-7-5-4-6-8-13/h4-10H,1-3H3
InChIKeyVEHRHQWFZNXKEY-UHFFFAOYSA-N
XLogP3.33
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate?
The IUPAC name of (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate (CID 142667852) is (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate.
What is the SMILES notation for (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate?
The canonical SMILES for (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate is Cc1cc(C)nc(OC(=O)N(C)c2ccccc2)c1.
What is the InChIKey of (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate?
The InChIKey is VEHRHQWFZNXKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11-9-12(2)16-14(10-11)19-15(18)17(3)13-7-5-4-6-8-13/h4-10H,1-3H3.
What are the key properties of (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate?
(4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate has a molecular weight of 256.31 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,6-dimethyl-2-pyridinyl) N-methyl-N-phenylcarbamate is sourced from PubChem (CID 142667852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).