[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate

C22H20N2O6 — CID 4848536

IUPAC[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate
SMILESCOc1ccccc1NC(=O)Oc1cccc(OC(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C22H20N2O6/c1-27-19-12-5-3-10-17(19)23-21(25)29-15-8-7-9-16(14-15)30-22(26)24-18-11-4-6-13-20(18)28-2/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChIKeyDHXXFEHILXHIBY-UHFFFAOYSA-N
MW408.41 g/mol
LogP4.93
Rot. Bonds6

About [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate

[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate (PubChem CID 4848536) has the molecular formula C22H20N2O6 and a molecular weight of 408.41 g/mol. Its IUPAC name is [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate.

Molecular Properties

Compound Name[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate
PubChem CID4848536
Molecular FormulaC22H20N2O6
Molecular Weight408.41 g/mol
Exact Mass408.13
IUPAC Name[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate
SMILESCOc1ccccc1NC(=O)Oc1cccc(OC(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C22H20N2O6/c1-27-19-12-5-3-10-17(19)23-21(25)29-15-8-7-9-16(14-15)30-22(26)24-18-11-4-6-13-20(18)28-2/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChIKeyDHXXFEHILXHIBY-UHFFFAOYSA-N
XLogP4.93
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.41
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(1-methylbenzimidazol-5-yl) N-(2-methoxyphenyl)carbamate
CID 90538276
2-(3-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 19203871
(2,6-dimethoxyphenyl) N-(2,5-dimethoxyphenyl)carbamate
CID 3325255
5-[(2-carboxyphenyl)carbamoyloxy]-2-methoxybenzoic acid
CID 18974701
propan-2-yl N-(2-methoxyphenyl)carbamate
CID 5047637
phenyl N-(2-ethoxyphenyl)carbamate
CID 51345560
ethane;(2-methoxyphenyl)urea
CID 143063924
phenyl N-(2-methoxy-5-nitrophenyl)carbamate
CID 12941467
(2R)-2-(3-methoxyphenoxy)-N-(2-methoxyphenyl)butanamide
CID 94027055
methyl (E)-4-(2-methoxyanilino)-4-oxobut-2-enoate
CID 851837
(2R)-2-bromo-N-(2-methoxyphenyl)propanamide
CID 737002
N-(2-methoxyphenyl)-4-(3-methylphenoxy)butanamide
CID 19173646

Frequently Asked Questions

What is the IUPAC name of [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate?
The IUPAC name of [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate (CID 4848536) is [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate.
What is the SMILES notation for [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate?
The canonical SMILES for [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate is COc1ccccc1NC(=O)Oc1cccc(OC(=O)Nc2ccccc2OC)c1.
What is the InChIKey of [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate?
The InChIKey is DHXXFEHILXHIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O6/c1-27-19-12-5-3-10-17(19)23-21(25)29-15-8-7-9-16(14-15)30-22(26)24-18-11-4-6-13-20(18)28-2/h3-14H,1-2H3,(H,23,25)(H,24,26).
What are the key properties of [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate?
[3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate has a molecular weight of 408.41 g/mol, XLogP of 4.93, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-methoxyphenyl)carbamoyloxy]phenyl] N-(2-methoxyphenyl)carbamate is sourced from PubChem (CID 4848536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).