2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride

C14H23ClN2O3 — CID 119289402

IUPAC2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccc(OCCOC)cc1.Cl
InChIInChI=1S/C14H22N2O3.ClH/c1-3-4-13(15)14(17)16-11-5-7-12(8-6-11)19-10-9-18-2;/h5-8,13H,3-4,9-10,15H2,1-2H3,(H,16,17);1H
InChIKeyWKJRAOYNBYHLPS-UHFFFAOYSA-N
MW302.80 g/mol
LogP2.20
Rot. Bonds8

About 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride

2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride (PubChem CID 119289402) has the molecular formula C14H23ClN2O3 and a molecular weight of 302.80 g/mol. Its IUPAC name is 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
PubChem CID119289402
Molecular FormulaC14H23ClN2O3
Molecular Weight302.80 g/mol
Exact Mass302.14
IUPAC Name2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccc(OCCOC)cc1.Cl
InChIInChI=1S/C14H22N2O3.ClH/c1-3-4-13(15)14(17)16-11-5-7-12(8-6-11)19-10-9-18-2;/h5-8,13H,3-4,9-10,15H2,1-2H3,(H,16,17);1H
InChIKeyWKJRAOYNBYHLPS-UHFFFAOYSA-N
XLogP2.20
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.80
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(4-ethoxyphenyl)-4-methoxybutanamide
CID 55080527
2-amino-N-(4-phenylmethoxyphenyl)pentanamide;hydrochloride
CID 119261538
2-amino-N-(4-propan-2-yloxyphenyl)pentanamide;hydrochloride
CID 119280465
2-amino-N-[3-chloro-4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
CID 119298223
2-amino-N-[4-(2-amino-2-oxoethoxy)phenyl]-4-methoxybutanamide
CID 62475184
(2S)-2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]pentanamide
CID 107568581
2-amino-N-[4-(cyclopropylmethoxy)phenyl]pentanamide
CID 119325264
2-amino-N-[3-fluoro-4-(2-methoxyethoxy)phenyl]pentanamide
CID 119302610
(2R)-N-(4-acetamidophenyl)-2-aminopentanamide
CID 113263757
2-amino-N-(4-propoxyphenyl)propanamide
CID 62327124
methyl 2-[4-[(2-amino-3-methoxypropanoyl)amino]phenoxy]acetate
CID 81083437
2-amino-4-methyl-N-(4-propoxyphenyl)pentanamide
CID 62329193

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride (CID 119289402) is 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride is CCCC(N)C(=O)Nc1ccc(OCCOC)cc1.Cl.
What is the InChIKey of 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride?
The InChIKey is WKJRAOYNBYHLPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3.ClH/c1-3-4-13(15)14(17)16-11-5-7-12(8-6-11)19-10-9-18-2;/h5-8,13H,3-4,9-10,15H2,1-2H3,(H,16,17);1H.
What are the key properties of 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride?
2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride has a molecular weight of 302.80 g/mol, XLogP of 2.20, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride is sourced from PubChem (CID 119289402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).