ethyl N-[4-(methoxymethoxy)phenyl]carbamate

C11H15NO4 — CID 19896200

IUPACethyl N-[4-(methoxymethoxy)phenyl]carbamate
SMILESCCOC(=O)Nc1ccc(OCOC)cc1
InChIInChI=1S/C11H15NO4/c1-3-15-11(13)12-9-4-6-10(7-5-9)16-8-14-2/h4-7H,3,8H2,1-2H3,(H,12,13)
InChIKeyGDIFUVLIRASWHD-UHFFFAOYSA-N
MW225.24 g/mol
LogP2.24
Rot. Bonds5

About ethyl N-[4-(methoxymethoxy)phenyl]carbamate

ethyl N-[4-(methoxymethoxy)phenyl]carbamate (PubChem CID 19896200) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is ethyl N-[4-(methoxymethoxy)phenyl]carbamate.

Molecular Properties

Compound Nameethyl N-[4-(methoxymethoxy)phenyl]carbamate
PubChem CID19896200
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Nameethyl N-[4-(methoxymethoxy)phenyl]carbamate
SMILESCCOC(=O)Nc1ccc(OCOC)cc1
InChIInChI=1S/C11H15NO4/c1-3-15-11(13)12-9-4-6-10(7-5-9)16-8-14-2/h4-7H,3,8H2,1-2H3,(H,12,13)
InChIKeyGDIFUVLIRASWHD-UHFFFAOYSA-N
XLogP2.24
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

ethyl N-[4-(2,2,2-trifluoroethoxy)phenyl]carbamate
CID 60705257
methyl 1-[[4-(ethoxycarbonylamino)phenoxy]methyl]cyclopropane-1-carboxylate
CID 122155305
ethane;ethyl N-(4-methylphenyl)carbamate
CID 143199598
ethyl N-(4-propan-2-yloxyphenyl)carbamate
CID 731078
bis(ethyl N-(4-ethoxyphenyl)carbamate);octa-3,5-diyne-1,8-diol
CID 160807108
ethyl N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamate
CID 17147479
ethyl N-[6-[4-(ethoxycarbonylamino)phenoxy]-3-pyridinyl]carbamate
CID 110176757
methyl N-[4-(2-methoxyethoxy)phenyl]carbamate
CID 110777023
ethyl N-(4-tert-butylphenyl)carbamate
CID 20519065
4-[(4-butoxyphenyl)carbamoyloxy]butyl N-(4-butoxyphenyl)carbamate
CID 122381911
ethyl N-[4-(pentan-3-ylamino)phenyl]carbamate
CID 43703992
ethyl N-[4-[(3-fluorophenyl)methoxy]phenyl]carbamate
CID 110359980

Frequently Asked Questions

What is the IUPAC name of ethyl N-[4-(methoxymethoxy)phenyl]carbamate?
The IUPAC name of ethyl N-[4-(methoxymethoxy)phenyl]carbamate (CID 19896200) is ethyl N-[4-(methoxymethoxy)phenyl]carbamate.
What is the SMILES notation for ethyl N-[4-(methoxymethoxy)phenyl]carbamate?
The canonical SMILES for ethyl N-[4-(methoxymethoxy)phenyl]carbamate is CCOC(=O)Nc1ccc(OCOC)cc1.
What is the InChIKey of ethyl N-[4-(methoxymethoxy)phenyl]carbamate?
The InChIKey is GDIFUVLIRASWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-3-15-11(13)12-9-4-6-10(7-5-9)16-8-14-2/h4-7H,3,8H2,1-2H3,(H,12,13).
What are the key properties of ethyl N-[4-(methoxymethoxy)phenyl]carbamate?
ethyl N-[4-(methoxymethoxy)phenyl]carbamate has a molecular weight of 225.24 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[4-(methoxymethoxy)phenyl]carbamate is sourced from PubChem (CID 19896200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).