2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide

C19H27Cl2N3O4S — CID 24642349

IUPAC2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
SMILESCC(C)CN1CCOC(CNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)C1
InChIInChI=1S/C19H27Cl2N3O4S/c1-12(2)10-24-5-6-28-14(11-24)9-22-19(25)15-7-18(17(21)8-16(15)20)29(26,27)23-13-3-4-13/h7-8,12-14,23H,3-6,9-11H2,1-2H3,(H,22,25)
InChIKeyNGEOHWDCXFJCOY-UHFFFAOYSA-N
MW464.42 g/mol
LogP2.52
Rot. Bonds8

About 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide

2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide (PubChem CID 24642349) has the molecular formula C19H27Cl2N3O4S and a molecular weight of 464.42 g/mol. Its IUPAC name is 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
PubChem CID24642349
Molecular FormulaC19H27Cl2N3O4S
Molecular Weight464.42 g/mol
Exact Mass463.11
IUPAC Name2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
SMILESCC(C)CN1CCOC(CNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)C1
InChIInChI=1S/C19H27Cl2N3O4S/c1-12(2)10-24-5-6-28-14(11-24)9-22-19(25)15-7-18(17(21)8-16(15)20)29(26,27)23-13-3-4-13/h7-8,12-14,23H,3-6,9-11H2,1-2H3,(H,22,25)
InChIKeyNGEOHWDCXFJCOY-UHFFFAOYSA-N
XLogP2.52
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.42
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide with MolForge

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Related Compounds

2-chloro-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]-5-methylsulfanylbenzamide
CID 39483842
4-chloro-2-fluoro-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 24642416
5-bromo-2-hydroxy-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 46523422
2-chloro-5-fluoro-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzenesulfonamide
CID 136523526
2-chloro-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyridine-4-carboxamide
CID 35365780
propan-2-yl 2-[[2,4-dichloro-5-(cyclopropylsulfamoyl)benzoyl]amino]acetate
CID 56543666
2,6-difluoro-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 39485652
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]cyclopropanecarboxamide
CID 95168375
2,4-dichloro-N-[[(2S)-oxolan-2-yl]methyl]-5-pyrrolidin-1-ylsulfonylbenzamide
CID 1091764
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 30538422
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-2-pyrrolidin-1-ylquinoline-3-carboxamide
CID 56559807
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[2-(diethylamino)ethyl]benzamide
CID 19257534

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide?
The IUPAC name of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide (CID 24642349) is 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide.
What is the SMILES notation for 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide?
The canonical SMILES for 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide is CC(C)CN1CCOC(CNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)C1.
What is the InChIKey of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide?
The InChIKey is NGEOHWDCXFJCOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27Cl2N3O4S/c1-12(2)10-24-5-6-28-14(11-24)9-22-19(25)15-7-18(17(21)8-16(15)20)29(26,27)23-13-3-4-13/h7-8,12-14,23H,3-6,9-11H2,1-2H3,(H,22,25).
What are the key properties of 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide?
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide has a molecular weight of 464.42 g/mol, XLogP of 2.52, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide is sourced from PubChem (CID 24642349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).