2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide

C19H24N4O2 — CID 6076209

IUPAC2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
SMILESC/C(=N\NC(=O)Cc1cccn1C)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H24N4O2/c1-15(20-21-19(24)14-18-4-3-9-22(18)2)16-5-7-17(8-6-16)23-10-12-25-13-11-23/h3-9H,10-14H2,1-2H3,(H,21,24)/b20-15+
InChIKeyRWOLGRAHCKNXCE-HMMYKYKNSA-N
MW340.43 g/mol
LogP1.94
Rot. Bonds5

About 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide

2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide (PubChem CID 6076209) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
PubChem CID6076209
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
SMILESC/C(=N\NC(=O)Cc1cccn1C)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H24N4O2/c1-15(20-21-19(24)14-18-4-3-9-22(18)2)16-5-7-17(8-6-16)23-10-12-25-13-11-23/h3-9H,10-14H2,1-2H3,(H,21,24)/b20-15+
InChIKeyRWOLGRAHCKNXCE-HMMYKYKNSA-N
XLogP1.94
TPSA58.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[1-(4-bromophenyl)ethylideneamino]-2-(1-methylpyrrol-2-yl)acetamide
CID 697308
2-(1-methylpyrrol-2-yl)-N-[(Z)-1-(4-nitrophenyl)ethylideneamino]acetamide
CID 5395320
4-amino-N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]benzamide
CID 6244951
2-(benzimidazol-1-yl)-N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
CID 9121210
4-(diethylamino)-N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]benzamide
CID 7929088
2-(2-chlorophenoxy)-N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
CID 9255870
5-[(Z)-C-methyl-N-[[2-(1-methylpyrrol-2-yl)acetyl]amino]carbonimidoyl]thiophene-2-carboxylic acid
CID 6261064
N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide
CID 7937167
2,5-dichloro-N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]benzamide
CID 6249278
N-[1-(4-morpholin-4-ylphenyl)ethylideneamino]-4-nitrobenzamide
CID 3959978
2-(5-methyl-2-propan-2-ylphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
CID 4119002
2-(5-methyl-2-propan-2-ylphenoxy)-N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide
CID 6014462

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide (CID 6076209) is 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide is C/C(=N\NC(=O)Cc1cccn1C)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide?
The InChIKey is RWOLGRAHCKNXCE-HMMYKYKNSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-15(20-21-19(24)14-18-4-3-9-22(18)2)16-5-7-17(8-6-16)23-10-12-25-13-11-23/h3-9H,10-14H2,1-2H3,(H,21,24)/b20-15+.
What are the key properties of 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide?
2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide has a molecular weight of 340.43 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrrol-2-yl)-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 6076209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).