2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride

C15H22Cl2N2O3 — CID 120987263

IUPAC2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride
SMILESCOCC(N)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1.Cl
InChIInChI=1S/C15H21ClN2O3.ClH/c1-20-9-13(17)15(19)18-10-6-7-14(12(16)8-10)21-11-4-2-3-5-11;/h6-8,11,13H,2-5,9,17H2,1H3,(H,18,19);1H
InChIKeyOEACCPHEVBNCEO-UHFFFAOYSA-N
MW349.26 g/mol
LogP3.00
Rot. Bonds6

About 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride

2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride (PubChem CID 120987263) has the molecular formula C15H22Cl2N2O3 and a molecular weight of 349.26 g/mol. Its IUPAC name is 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride
PubChem CID120987263
Molecular FormulaC15H22Cl2N2O3
Molecular Weight349.26 g/mol
Exact Mass348.10
IUPAC Name2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride
SMILESCOCC(N)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1.Cl
InChIInChI=1S/C15H21ClN2O3.ClH/c1-20-9-13(17)15(19)18-10-6-7-14(12(16)8-10)21-11-4-2-3-5-11;/h6-8,11,13H,2-5,9,17H2,1H3,(H,18,19);1H
InChIKeyOEACCPHEVBNCEO-UHFFFAOYSA-N
XLogP3.00
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.26
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)propanamide;hydrochloride
CID 119302889
1-(3-chloro-4-cyclopentyloxyphenyl)-3-(1-methoxypropan-2-yl)urea
CID 60577123
N-[(2R)-1-(3-chloro-4-cyclopentyloxyanilino)-1-oxopropan-2-yl]oxane-4-carboxamide
CID 95175612
2-amino-N-[3-chloro-4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
CID 119298223
3-(3-chloro-4-cyclopentyloxyphenyl)-1-(2-hydroxyethyl)-1-methylurea
CID 111431508
(2S)-N-(3-chloro-4-cyclopentyloxyphenyl)-2-hydroxy-2-(1-methylpyrazol-4-yl)acetamide
CID 124877193
(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide
CID 119336628
2-(aminomethyl)-N-(3-chloro-4-cyclopentyloxyphenyl)-1,3-thiazole-4-carboxamide
CID 119748052
2-amino-N-(3,4-dimethylphenyl)-3-methoxypropanamide
CID 81081537
2-amino-N-(4-chloro-2,5-dimethoxyphenyl)-3-methoxypropanamide
CID 81081918
2-amino-N-(1H-indol-5-yl)-3-methoxypropanamide;hydrochloride
CID 120984992
3-amino-N-(4-cyclopentyloxy-3-fluorophenyl)-2-methylbutanamide
CID 120501730

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride (CID 120987263) is 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride is COCC(N)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1.Cl.
What is the InChIKey of 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride?
The InChIKey is OEACCPHEVBNCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O3.ClH/c1-20-9-13(17)15(19)18-10-6-7-14(12(16)8-10)21-11-4-2-3-5-11;/h6-8,11,13H,2-5,9,17H2,1H3,(H,18,19);1H.
What are the key properties of 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride?
2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride has a molecular weight of 349.26 g/mol, XLogP of 3.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)-3-methoxypropanamide;hydrochloride is sourced from PubChem (CID 120987263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).