ethyl N-(2-anilino-4-methoxyphenyl)carbamate

C16H18N2O3 — CID 12930176

IUPACethyl N-(2-anilino-4-methoxyphenyl)carbamate
SMILESCCOC(=O)Nc1ccc(OC)cc1Nc1ccccc1
InChIInChI=1S/C16H18N2O3/c1-3-21-16(19)18-14-10-9-13(20-2)11-15(14)17-12-7-5-4-6-8-12/h4-11,17H,3H2,1-2H3,(H,18,19)
InChIKeyXWDGJHSCVJOIJW-UHFFFAOYSA-N
MW286.33 g/mol
LogP4.01
Rot. Bonds5

About ethyl N-(2-anilino-4-methoxyphenyl)carbamate

ethyl N-(2-anilino-4-methoxyphenyl)carbamate (PubChem CID 12930176) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is ethyl N-(2-anilino-4-methoxyphenyl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-anilino-4-methoxyphenyl)carbamate
PubChem CID12930176
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Nameethyl N-(2-anilino-4-methoxyphenyl)carbamate
SMILESCCOC(=O)Nc1ccc(OC)cc1Nc1ccccc1
InChIInChI=1S/C16H18N2O3/c1-3-21-16(19)18-14-10-9-13(20-2)11-15(14)17-12-7-5-4-6-8-12/h4-11,17H,3H2,1-2H3,(H,18,19)
InChIKeyXWDGJHSCVJOIJW-UHFFFAOYSA-N
XLogP4.01
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl N-(2-anilinophenyl)carbamate
CID 12930175
ethyl N-(2,4-dimethoxyphenyl)carbamate
CID 2741048
ethyl N-[4-chloro-2-(3-chloroanilino)phenyl]carbamate
CID 12930188
methyl N-[2,4-dianilino-5-(methoxycarbonylamino)phenyl]carbamate
CID 23026427
ethyl N-[3-(ethoxycarbonylamino)-4-(2-methoxyanilino)phenyl]carbamate
CID 110178963
ethyl N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]carbamate
CID 113034657
2-anilino-4-methoxy-N-methylbenzamide
CID 66646224
ethyl 2-(4-methoxyanilino)benzoate
CID 13424427
ethyl N-[(3-methoxyphenyl)carbamoyl]carbamate
CID 13221153
ethyl N-[3-[2-(2,4-dimethoxyanilino)-2-oxoethoxy]phenyl]carbamate
CID 2092397
ethyl N-[3-(ethoxycarbonylamino)phenyl]carbamate
CID 897252
ethyl N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]carbamate
CID 113019994

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-anilino-4-methoxyphenyl)carbamate?
The IUPAC name of ethyl N-(2-anilino-4-methoxyphenyl)carbamate (CID 12930176) is ethyl N-(2-anilino-4-methoxyphenyl)carbamate.
What is the SMILES notation for ethyl N-(2-anilino-4-methoxyphenyl)carbamate?
The canonical SMILES for ethyl N-(2-anilino-4-methoxyphenyl)carbamate is CCOC(=O)Nc1ccc(OC)cc1Nc1ccccc1.
What is the InChIKey of ethyl N-(2-anilino-4-methoxyphenyl)carbamate?
The InChIKey is XWDGJHSCVJOIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-3-21-16(19)18-14-10-9-13(20-2)11-15(14)17-12-7-5-4-6-8-12/h4-11,17H,3H2,1-2H3,(H,18,19).
What are the key properties of ethyl N-(2-anilino-4-methoxyphenyl)carbamate?
ethyl N-(2-anilino-4-methoxyphenyl)carbamate has a molecular weight of 286.33 g/mol, XLogP of 4.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-anilino-4-methoxyphenyl)carbamate is sourced from PubChem (CID 12930176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).