N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide

C15H19NO3S — CID 131962739

IUPACN-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide
SMILESCC(C(=O)NC1CC1)S(=O)(=O)CC=Cc1ccccc1
InChIInChI=1S/C15H19NO3S/c1-12(15(17)16-14-9-10-14)20(18,19)11-5-8-13-6-3-2-4-7-13/h2-8,12,14H,9-11H2,1H3,(H,16,17)
InChIKeyKVNQDGJHSDENRZ-UHFFFAOYSA-N
MW293.39 g/mol
LogP1.78
Rot. Bonds6

About N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide

N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide (PubChem CID 131962739) has the molecular formula C15H19NO3S and a molecular weight of 293.39 g/mol. Its IUPAC name is N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide
PubChem CID131962739
Molecular FormulaC15H19NO3S
Molecular Weight293.39 g/mol
Exact Mass293.11
IUPAC NameN-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide
SMILESCC(C(=O)NC1CC1)S(=O)(=O)CC=Cc1ccccc1
InChIInChI=1S/C15H19NO3S/c1-12(15(17)16-14-9-10-14)20(18,19)11-5-8-13-6-3-2-4-7-13/h2-8,12,14H,9-11H2,1H3,(H,16,17)
InChIKeyKVNQDGJHSDENRZ-UHFFFAOYSA-N
XLogP1.78
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-but-2-enylsulfonyl-N-cyclohexylpropanamide
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[2-(cyclopropylamino)-2-oxoethyl]-methyl-[(E)-3-phenylprop-2-enyl]azanium
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(2S)-N-cyclopropyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]propanamide
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(2R)-N-cyclopropyl-2-[(3-phenyl-1,2-oxazol-5-yl)methylsulfonyl]propanamide
CID 94087908
N-cyclopentyl-2-[(2-methylphenyl)methylsulfonyl]propanamide
CID 42961400
2-[1-(cyclopropylamino)-1-oxopropan-2-yl]sulfonylbenzoic acid
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2-[(3-chlorophenyl)methylsulfonyl]-N-cyclopropylpropanamide
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N-(4-hydroxycyclohexyl)-2-(3-phenylprop-2-enoylamino)propanamide
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(2R)-N-cyclopropyl-2-(N-methylsulfonylanilino)propanamide
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[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl] (2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoate
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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide?
The IUPAC name of N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide (CID 131962739) is N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide.
What is the SMILES notation for N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide?
The canonical SMILES for N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide is CC(C(=O)NC1CC1)S(=O)(=O)CC=Cc1ccccc1.
What is the InChIKey of N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide?
The InChIKey is KVNQDGJHSDENRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3S/c1-12(15(17)16-14-9-10-14)20(18,19)11-5-8-13-6-3-2-4-7-13/h2-8,12,14H,9-11H2,1H3,(H,16,17).
What are the key properties of N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide?
N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide has a molecular weight of 293.39 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3-phenylprop-2-enylsulfonyl)propanamide is sourced from PubChem (CID 131962739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).