3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide

C19H24ClN5O3S — CID 26126632

IUPAC3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
SMILESCN1CCN(c2ccc(NC(=O)CCNS(=O)(=O)c3ccccc3Cl)cn2)CC1
InChIInChI=1S/C19H24ClN5O3S/c1-24-10-12-25(13-11-24)18-7-6-15(14-21-18)23-19(26)8-9-22-29(27,28)17-5-3-2-4-16(17)20/h2-7,14,22H,8-13H2,1H3,(H,23,26)
InChIKeyOGZKFZKDNCVVTL-UHFFFAOYSA-N
MW437.95 g/mol
LogP1.79
Rot. Bonds7

About 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide

3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide (PubChem CID 26126632) has the molecular formula C19H24ClN5O3S and a molecular weight of 437.95 g/mol. Its IUPAC name is 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
PubChem CID26126632
Molecular FormulaC19H24ClN5O3S
Molecular Weight437.95 g/mol
Exact Mass437.13
IUPAC Name3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
SMILESCN1CCN(c2ccc(NC(=O)CCNS(=O)(=O)c3ccccc3Cl)cn2)CC1
InChIInChI=1S/C19H24ClN5O3S/c1-24-10-12-25(13-11-24)18-7-6-15(14-21-18)23-19(26)8-9-22-29(27,28)17-5-3-2-4-16(17)20/h2-7,14,22H,8-13H2,1H3,(H,23,26)
InChIKeyOGZKFZKDNCVVTL-UHFFFAOYSA-N
XLogP1.79
TPSA94.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.95
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanamide
CID 24610754
2-(4-chlorophenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]acetamide
CID 17444414
3-[(2-chlorophenyl)sulfonylamino]-N-(4-ethylphenyl)propanamide
CID 26697206
ethyl 6-[4-[3-[(2-chlorophenyl)sulfonylamino]propanoyl]piperazin-1-yl]pyridine-3-carboxylate
CID 55636719
3-[(2-chlorophenyl)sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide
CID 35026494
2-(2-chlorophenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 51321278
3-[(2-chlorophenyl)sulfonylamino]-N-(5-morpholin-4-yl-2-pyridinyl)propanamide
CID 38142028
3-acetamido-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 47140496
2-chloro-N-[6-(4-formylpiperazin-1-yl)-3-pyridinyl]benzenesulfonamide
CID 113011206
3-[(2-chlorophenyl)sulfonylamino]-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]propanamide
CID 55653308
3-amino-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]butanamide
CID 120872707
3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
CID 37334790

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide?
The IUPAC name of 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide (CID 26126632) is 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide.
What is the SMILES notation for 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide?
The canonical SMILES for 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide is CN1CCN(c2ccc(NC(=O)CCNS(=O)(=O)c3ccccc3Cl)cn2)CC1.
What is the InChIKey of 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide?
The InChIKey is OGZKFZKDNCVVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClN5O3S/c1-24-10-12-25(13-11-24)18-7-6-15(14-21-18)23-19(26)8-9-22-29(27,28)17-5-3-2-4-16(17)20/h2-7,14,22H,8-13H2,1H3,(H,23,26).
What are the key properties of 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide?
3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide has a molecular weight of 437.95 g/mol, XLogP of 1.79, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chlorophenyl)sulfonylamino]-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide is sourced from PubChem (CID 26126632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).