2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride

C14H23Cl2N3O2 — CID 20847919

IUPAC2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
SMILESCCNCC(=O)Nc1ccc(N2CCOCC2)cc1.Cl.Cl
InChIInChI=1S/C14H21N3O2.2ClH/c1-2-15-11-14(18)16-12-3-5-13(6-4-12)17-7-9-19-10-8-17;;/h3-6,15H,2,7-11H2,1H3,(H,16,18);2*1H
InChIKeyWAQDPGVSGMBZFW-UHFFFAOYSA-N
MW336.26 g/mol
LogP1.91
Rot. Bonds5

About 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride

2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride (PubChem CID 20847919) has the molecular formula C14H23Cl2N3O2 and a molecular weight of 336.26 g/mol. Its IUPAC name is 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
PubChem CID20847919
Molecular FormulaC14H23Cl2N3O2
Molecular Weight336.26 g/mol
Exact Mass335.12
IUPAC Name2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
SMILESCCNCC(=O)Nc1ccc(N2CCOCC2)cc1.Cl.Cl
InChIInChI=1S/C14H21N3O2.2ClH/c1-2-15-11-14(18)16-12-3-5-13(6-4-12)17-7-9-19-10-8-17;;/h3-6,15H,2,7-11H2,1H3,(H,16,18);2*1H
InChIKeyWAQDPGVSGMBZFW-UHFFFAOYSA-N
XLogP1.91
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.26
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(4-morpholin-4-ylphenyl)pentanamide
CID 2765048
2-amino-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]acetamide
CID 61253868
2-[methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]amino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 4831881
N-(4-morpholin-4-ylphenyl)-2-(2-propylanilino)acetamide
CID 33171709
3-amino-N-(4-morpholin-4-ylphenyl)propanamide
CID 61252883
methyl 4-(4-morpholin-4-ylanilino)-4-oxobutanoate
CID 51985182
4-tert-butyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]benzamide
CID 17475542
2-(2-morpholin-4-ylethylamino)-N-(4-piperidin-1-ylphenyl)acetamide
CID 43816686
N-(4-morpholin-4-ylphenyl)-2-(2,4,6-trimethylphenyl)sulfanylacetamide
CID 7751943
N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
CID 110424765
N-tert-butyl-4-[[2-(4-morpholin-4-ylanilino)-2-oxoethyl]amino]benzamide
CID 31699427
2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
CID 18078616

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride?
The IUPAC name of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride (CID 20847919) is 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride.
What is the SMILES notation for 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride?
The canonical SMILES for 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride is CCNCC(=O)Nc1ccc(N2CCOCC2)cc1.Cl.Cl.
What is the InChIKey of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride?
The InChIKey is WAQDPGVSGMBZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2.2ClH/c1-2-15-11-14(18)16-12-3-5-13(6-4-12)17-7-9-19-10-8-17;;/h3-6,15H,2,7-11H2,1H3,(H,16,18);2*1H.
What are the key properties of 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride?
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride has a molecular weight of 336.26 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride is sourced from PubChem (CID 20847919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).