(4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate

C14H20N2O3 — CID 116819285

IUPAC(4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate
SMILESCCOc1ccc(OC(=O)N2CCC(N)CC2)cc1
InChIInChI=1S/C14H20N2O3/c1-2-18-12-3-5-13(6-4-12)19-14(17)16-9-7-11(15)8-10-16/h3-6,11H,2,7-10,15H2,1H3
InChIKeySDENZIFWRBMHGC-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.01
Rot. Bonds3

About (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate

(4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate (PubChem CID 116819285) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate.

Molecular Properties

Compound Name(4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate
PubChem CID116819285
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name(4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate
SMILESCCOc1ccc(OC(=O)N2CCC(N)CC2)cc1
InChIInChI=1S/C14H20N2O3/c1-2-18-12-3-5-13(6-4-12)19-14(17)16-9-7-11(15)8-10-16/h3-6,11H,2,7-10,15H2,1H3
InChIKeySDENZIFWRBMHGC-UHFFFAOYSA-N
XLogP2.01
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-ethoxyphenyl) 3-aminopyrrolidine-1-carboxylate
CID 116819452
1-(4-aminopiperidin-1-yl)-4-(4-ethoxyphenoxy)butan-1-one;hydrochloride
CID 119373343
(3-aminopyrrolidin-1-yl)-(4-ethoxyphenyl)methanone
CID 62068283
(E)-1-(4-aminopiperidin-1-yl)-3-(4-ethoxyphenyl)prop-2-en-1-one
CID 82043241
1-(4-aminopiperidin-1-yl)-4-(4-ethoxyphenyl)butane-1,4-dione;hydrochloride
CID 119376549
(4-ethoxyphenyl) 1,4-diazepane-1-carboxylate
CID 82303735
bis(4-dodecoxyphenyl) piperidine-1,4-dicarboxylate
CID 14473790
1-O-(4-chlorophenyl) 4-O-ethyl piperidine-1,4-dicarboxylate
CID 127548047
4-O-ethyl 1-O-phenyl piperidine-1,4-dicarboxylate
CID 3851418
ethyl 4-[(4-ethoxybenzoyl)amino]piperidine-1-carboxylate
CID 31542192
phenyl 3-aminopyrrolidine-1-carboxylate
CID 62067214
phenyl 4-propylpiperidine-1-carboxylate
CID 64591892

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate?
The IUPAC name of (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate (CID 116819285) is (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate.
What is the SMILES notation for (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate?
The canonical SMILES for (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate is CCOc1ccc(OC(=O)N2CCC(N)CC2)cc1.
What is the InChIKey of (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate?
The InChIKey is SDENZIFWRBMHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-18-12-3-5-13(6-4-12)19-14(17)16-9-7-11(15)8-10-16/h3-6,11H,2,7-10,15H2,1H3.
What are the key properties of (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate?
(4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate has a molecular weight of 264.32 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl) 4-aminopiperidine-1-carboxylate is sourced from PubChem (CID 116819285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).