1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate

HCID 46148

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Basic information

CAS: 63986-59-4
Standard SMILES: CCCCOc1ccc(NC(=O)OC(C)CN2CCCCC2)c(C)c1
InChIKey: FEMVZCRCQVTNMD-UHFFFAOYSA-N
Molecular formula: C20H32N2O3
Average molar mass: 348.5 g/mol
Monoisotopic mass: 348.24129289

Names & identifiers

Preferred name: 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate
IUPAC: 1-piperidin-1-ylpropan-2-yl N-(4-butoxy-2-methylphenyl)carbamate

Names & synonyms

63986-59-4DTXSID409817081-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamateRefChem:1054749DTXCID7014089771-(Piperidinomethyl)ethyl 4-butoxy-2-methylcarbanilateKL 36334-Butoxy-2-methylcarbanilic acid 1-(piperidinomethyl)ethyl esterCARBANILIC ACID, 4-BUTOXY-2-METHYL-, 1-(PIPERIDINOMETHYL)ETHYL ESTER

Database identifiers

CAS: 63986-59-4
PubChem CID: 46148
DTXSID: DTXSID40981708

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 50.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 9
Heavy atoms: 25
Formal charge: 0
Complexity: 385

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