methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate

C17H20N2O3 — CID 139810973

IUPACmethyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate
SMILESCCc1ccc(COc2ccc(NC(=O)OC)c(C)c2)nc1
InChIInChI=1S/C17H20N2O3/c1-4-13-5-6-14(18-10-13)11-22-15-7-8-16(12(2)9-15)19-17(20)21-3/h5-10H,4,11H2,1-3H3,(H,19,20)
InChIKeyBGUXVQKKLRWUTL-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.71
Rot. Bonds5

About methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate

methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate (PubChem CID 139810973) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate.

Molecular Properties

Compound Namemethyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate
PubChem CID139810973
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Namemethyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate
SMILESCCc1ccc(COc2ccc(NC(=O)OC)c(C)c2)nc1
InChIInChI=1S/C17H20N2O3/c1-4-13-5-6-14(18-10-13)11-22-15-7-8-16(12(2)9-15)19-17(20)21-3/h5-10H,4,11H2,1-3H3,(H,19,20)
InChIKeyBGUXVQKKLRWUTL-UHFFFAOYSA-N
XLogP3.71
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 ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl N-[2-methyl-4-[(6-methyl-3-pyridinyl)methoxy]phenyl]carbamate
CID 139811023
methyl N-[2-methyl-4-[(5-methylpyrazin-2-yl)methoxy]phenyl]carbamate
CID 139811034
methyl N-[4-[(5,6-dichloro-3-pyridinyl)methoxy]-2-methylphenyl]carbamate
CID 139811113
methyl N-[4-[(4-methoxythiophen-3-yl)methoxy]-2-methylphenyl]carbamate
CID 139811024
methyl N-[4-[(2-chloro-6-methoxy-4-pyridinyl)methoxy]-2-methylphenyl]carbamate
CID 139811030
methyl N-[2-methyl-4-[(3-methyl-1-benzothiophen-2-yl)methoxy]phenyl]carbamate
CID 139811068
(2-methyl-4-propoxyphenyl)carbamic acid
CID 118108315
methyl N-[2-methyl-4-[(2-phenylsulfanyl-3-pyridinyl)methoxy]phenyl]carbamate
CID 139810963
tert-butyl N-(4-butoxy-2-methylphenyl)carbamate
CID 140675962
methyl 6-[(4-bromo-3,5-dimethylphenoxy)methyl]pyridine-3-carboxylate
CID 107722368
2-chloro-N-[2-methyl-4-[(4-methylphenyl)methoxy]phenyl]acetamide
CID 39431489
N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide
CID 86827111

Frequently Asked Questions

What is the IUPAC name of methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate?
The IUPAC name of methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate (CID 139810973) is methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate.
What is the SMILES notation for methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate?
The canonical SMILES for methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate is CCc1ccc(COc2ccc(NC(=O)OC)c(C)c2)nc1.
What is the InChIKey of methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate?
The InChIKey is BGUXVQKKLRWUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-4-13-5-6-14(18-10-13)11-22-15-7-8-16(12(2)9-15)19-17(20)21-3/h5-10H,4,11H2,1-3H3,(H,19,20).
What are the key properties of methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate?
methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate has a molecular weight of 300.36 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[4-[(5-ethyl-2-pyridinyl)methoxy]-2-methylphenyl]carbamate is sourced from PubChem (CID 139810973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).