(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate

C17H19NO6 — CID 3325255

IUPAC(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate
SMILESCOc1ccc(OC)c(NC(=O)Oc2c(OC)cccc2OC)c1
InChIInChI=1S/C17H19NO6/c1-20-11-8-9-13(21-2)12(10-11)18-17(19)24-16-14(22-3)6-5-7-15(16)23-4/h5-10H,1-4H3,(H,18,19)
InChIKeyKJIHLBKPZLIGRZ-UHFFFAOYSA-N
MW333.34 g/mol
LogP3.33
Rot. Bonds6

About (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate

(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate (PubChem CID 3325255) has the molecular formula C17H19NO6 and a molecular weight of 333.34 g/mol. Its IUPAC name is (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate.

Molecular Properties

Compound Name(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate
PubChem CID3325255
Molecular FormulaC17H19NO6
Molecular Weight333.34 g/mol
Exact Mass333.12
IUPAC Name(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate
SMILESCOc1ccc(OC)c(NC(=O)Oc2c(OC)cccc2OC)c1
InChIInChI=1S/C17H19NO6/c1-20-11-8-9-13(21-2)12(10-11)18-17(19)24-16-14(22-3)6-5-7-15(16)23-4/h5-10H,1-4H3,(H,18,19)
InChIKeyKJIHLBKPZLIGRZ-UHFFFAOYSA-N
XLogP3.33
TPSA75.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate
CID 4848536
(4-methoxyphenyl) N-(5-chloro-2-methoxyphenyl)carbamate
CID 3332616
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide
CID 35495479
[2-(2,5-dimethoxyanilino)-2-oxoethyl] 2,6-dimethoxybenzoate
CID 2515970
N'-(2,5-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)propanediamide
CID 108955778
N-(2,5-dimethoxyphenyl)-2-(3-methoxyphenoxy)acetamide
CID 19204029
N-(2,5-dimethoxyphenyl)prop-2-enamide
CID 881958
methyl N-[(2,5-dimethoxyphenyl)carbamothioylamino]carbamate
CID 970721
5-bromo-N-(2,5-dimethoxyphenyl)naphthalene-1-carboxamide
CID 1369979
1-(2,5-dimethoxyphenyl)-3-[2-(2-methoxyphenoxy)ethyl]urea
CID 17171312
N-(2,5-dimethoxyphenyl)-3-(trifluoromethyl)benzamide
CID 531811

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate?
The IUPAC name of (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate (CID 3325255) is (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate.
What is the SMILES notation for (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate?
The canonical SMILES for (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate is COc1ccc(OC)c(NC(=O)Oc2c(OC)cccc2OC)c1.
What is the InChIKey of (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate?
The InChIKey is KJIHLBKPZLIGRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO6/c1-20-11-8-9-13(21-2)12(10-11)18-17(19)24-16-14(22-3)6-5-7-15(16)23-4/h5-10H,1-4H3,(H,18,19).
What are the key properties of (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate?
(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate has a molecular weight of 333.34 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate is sourced from PubChem (CID 3325255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).