1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide

C15H22N2O3 — CID 79637862

IUPAC1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide
SMILESCCOc1ccccc1OC1CCCC(N)(C(N)=O)C1
InChIInChI=1S/C15H22N2O3/c1-2-19-12-7-3-4-8-13(12)20-11-6-5-9-15(17,10-11)14(16)18/h3-4,7-8,11H,2,5-6,9-10,17H2,1H3,(H2,16,18)
InChIKeyKCCVTWXDKVIGPK-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.59
Rot. Bonds5

About 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide

1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide (PubChem CID 79637862) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide
PubChem CID79637862
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide
SMILESCCOc1ccccc1OC1CCCC(N)(C(N)=O)C1
InChIInChI=1S/C15H22N2O3/c1-2-19-12-7-3-4-8-13(12)20-11-6-5-9-15(17,10-11)14(16)18/h3-4,7-8,11H,2,5-6,9-10,17H2,1H3,(H2,16,18)
InChIKeyKCCVTWXDKVIGPK-UHFFFAOYSA-N
XLogP1.59
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-amino-3-(2-ethoxyphenoxy)cyclopentane-1-carboxylate
CID 79648377
1-amino-3-(2-methylphenoxy)cyclopentane-1-carboxamide
CID 79648383
1-amino-3-[3-(hydroxymethyl)phenoxy]cyclohexane-1-carboxamide
CID 79637537
1-amino-3-(2-chloro-5-nitrophenoxy)cyclohexane-1-carboxamide
CID 79635447
N-carbamoyl-3-[4-(2-ethoxyphenoxy)piperidin-1-yl]propanamide
CID 47073341
1-[6-[(3R)-3-(2-ethoxyphenoxy)piperidin-1-yl]pyrazin-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 156541117
1-(ethylamino)-3-(2-methoxyphenoxy)cyclopentane-1-carboxamide
CID 79649310
3-(2-ethoxyphenoxy)-N-methylcyclohexan-1-amine
CID 79619308
methyl 1-amino-3-(2-butan-2-ylphenoxy)cyclopentane-1-carboxylate
CID 79647954
2-cyclopent-2-en-1-yl-1-[4-(2-ethoxyphenoxy)piperidin-1-yl]ethanone
CID 51092131
3-(2-ethoxyphenoxy)piperidine;hydrochloride
CID 118366272
[1-amino-3-(2-butan-2-ylphenoxy)cyclohexyl]methanol
CID 79641071

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide (CID 79637862) is 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide is CCOc1ccccc1OC1CCCC(N)(C(N)=O)C1.
What is the InChIKey of 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide?
The InChIKey is KCCVTWXDKVIGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-2-19-12-7-3-4-8-13(12)20-11-6-5-9-15(17,10-11)14(16)18/h3-4,7-8,11H,2,5-6,9-10,17H2,1H3,(H2,16,18).
What are the key properties of 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide?
1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(2-ethoxyphenoxy)cyclohexane-1-carboxamide is sourced from PubChem (CID 79637862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).