phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate

C17H20N2O3 — CID 18663163

IUPACphenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate
SMILESCCOc1nc(C)c(CC)cc1NC(=O)Oc1ccccc1
InChIInChI=1S/C17H20N2O3/c1-4-13-11-15(16(21-5-2)18-12(13)3)19-17(20)22-14-9-7-6-8-10-14/h6-11H,4-5H2,1-3H3,(H,19,20)
InChIKeyYXXQCLVZKASTJT-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.96
Rot. Bonds5

About phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate

phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate (PubChem CID 18663163) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate.

Molecular Properties

Compound Namephenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate
PubChem CID18663163
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Namephenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate
SMILESCCOc1nc(C)c(CC)cc1NC(=O)Oc1ccccc1
InChIInChI=1S/C17H20N2O3/c1-4-13-11-15(16(21-5-2)18-12(13)3)19-17(20)22-14-9-7-6-8-10-14/h6-11H,4-5H2,1-3H3,(H,19,20)
InChIKeyYXXQCLVZKASTJT-UHFFFAOYSA-N
XLogP3.96
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

phenyl N-(2-ethoxyphenyl)carbamate
CID 51345560
phenyl N-(5-acetyl-2-methoxy-6-methyl-3-pyridinyl)carbamate
CID 19357047
phenyl N-[7-(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)heptyl]carbamate
CID 139808372
phenyl N-(5-ethoxy-2-fluoro-4-methylphenyl)carbamate
CID 164584343
phenyl N-(2,6-dimethylquinolin-3-yl)carbamate
CID 155691129
phenyl N-(4-methyl-2-propoxyphenyl)carbamate
CID 61216988
2-methyl-6-(phenoxycarbonylamino)pyridine-3-carboxylic acid
CID 90422775
phenyl N-(4-ethyl-6-methoxypyrimidin-2-yl)carbamate
CID 21467947
4-(3,5-dimethoxyphenyl)-N-(5-ethyl-6-methyl-2-phenoxy-3-pyridinyl)piperazine-1-carboxamide
CID 18663143
phenyl N-(3-ethoxy-4-fluoro-1-phenylpyrazol-5-yl)carbamate
CID 118148426
4-methyl-5-(phenoxycarbonylamino)phthalic acid
CID 67543732
phenyl N-(2-bromo-4-methylphenyl)carbamate
CID 3453949

Frequently Asked Questions

What is the IUPAC name of phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate?
The IUPAC name of phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate (CID 18663163) is phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate.
What is the SMILES notation for phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate?
The canonical SMILES for phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate is CCOc1nc(C)c(CC)cc1NC(=O)Oc1ccccc1.
What is the InChIKey of phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate?
The InChIKey is YXXQCLVZKASTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-4-13-11-15(16(21-5-2)18-12(13)3)19-17(20)22-14-9-7-6-8-10-14/h6-11H,4-5H2,1-3H3,(H,19,20).
What are the key properties of phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate?
phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate has a molecular weight of 300.36 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(2-ethoxy-5-ethyl-6-methyl-3-pyridinyl)carbamate is sourced from PubChem (CID 18663163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).