Carbamic acid,[2-amino-4-chloro-5-[methyl(2-methylpropyl)amino]phenyl]-,1,1-dimethylethyl ester

HCID 69487013

Basic information

Standard SMILES
CC(C)CN(C)c1cc(NC(=O)OC(C)(C)C)c(N)cc1Cl
InChIKey
SWEAKJSASQXXAU-UHFFFAOYSA-N
Molecular formula
C16H26ClN3O2
Average molar mass
327.8 g/mol

Names & identifiers

Preferred name
Carbamic acid,[2-amino-4-chloro-5-[methyl(2-methylpropyl)amino]phenyl]-,1,1-dimethylethyl ester
IUPAC
tert-butyl N-[2-amino-4-chloro-5-[methyl(2-methylpropyl)amino]phenyl]carbamate

Names & synonyms

473547-81-8carbamic acid,[2-amino-4-chloro-5-[methyl(2-methylpropyl)amino]phenyl]-,1,1-dimethylethyl esterSCHEMBL5558131SWEAKJSASQXXAU-UHFFFAOYSA-NDB-214495Tert-butyl 5-(n-isobutyl-N-methylamino)-2-amino-4-chlorophenylcarbamate[2-Amino-4-chloro-5-(isobutyl-methyl-amino)-phenyl]-carbamic acid tert-butyl ester

Database identifiers

PubChem CID
69487013

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
67.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
22

Related reactions

13 records

Compound notes

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