N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride

C16H23ClN2O3 — CID 119714810

IUPACN-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(OC2CCCC2)cc1)C1CNCCO1
InChIInChI=1S/C16H22N2O3.ClH/c19-16(15-11-17-9-10-20-15)18-12-5-7-14(8-6-12)21-13-3-1-2-4-13;/h5-8,13,15,17H,1-4,9-11H2,(H,18,19);1H
InChIKeyABPAGMGQMUWHDK-UHFFFAOYSA-N
MW326.82 g/mol
LogP2.36
Rot. Bonds4

About N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride

N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119714810) has the molecular formula C16H23ClN2O3 and a molecular weight of 326.82 g/mol. Its IUPAC name is N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119714810
Molecular FormulaC16H23ClN2O3
Molecular Weight326.82 g/mol
Exact Mass326.14
IUPAC NameN-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(OC2CCCC2)cc1)C1CNCCO1
InChIInChI=1S/C16H22N2O3.ClH/c19-16(15-11-17-9-10-20-15)18-12-5-7-14(8-6-12)21-13-3-1-2-4-13;/h5-8,13,15,17H,1-4,9-11H2,(H,18,19);1H
InChIKeyABPAGMGQMUWHDK-UHFFFAOYSA-N
XLogP2.36
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.82
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride (CID 119714810) is N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(OC2CCCC2)cc1)C1CNCCO1.
What is the InChIKey of N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is ABPAGMGQMUWHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3.ClH/c19-16(15-11-17-9-10-20-15)18-12-5-7-14(8-6-12)21-13-3-1-2-4-13;/h5-8,13,15,17H,1-4,9-11H2,(H,18,19);1H.
What are the key properties of N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride?
N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 326.82 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxyphenyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119714810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).