3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide

C18H23N3O3S — CID 9271723

IUPAC3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide
SMILESO=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NN1CCCCC1
InChIInChI=1S/C18H23N3O3S/c22-18(20-21-12-4-1-5-13-21)10-11-19-25(23,24)17-9-8-15-6-2-3-7-16(15)14-17/h2-3,6-9,14,19H,1,4-5,10-13H2,(H,20,22)
InChIKeyMSYGDRJHHXXSES-UHFFFAOYSA-N
MW361.47 g/mol
LogP2.03
Rot. Bonds6

About 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide

3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide (PubChem CID 9271723) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide.

Molecular Properties

Compound Name3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide
PubChem CID9271723
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC Name3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide
SMILESO=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NN1CCCCC1
InChIInChI=1S/C18H23N3O3S/c22-18(20-21-12-4-1-5-13-21)10-11-19-25(23,24)17-9-8-15-6-2-3-7-16(15)14-17/h2-3,6-9,14,19H,1,4-5,10-13H2,(H,20,22)
InChIKeyMSYGDRJHHXXSES-UHFFFAOYSA-N
XLogP2.03
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(naphthalen-2-ylsulfonylamino)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
CID 17459741
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-(naphthalen-2-ylsulfonylamino)propanamide
CID 27533515
N-methyl-3-(naphthalen-2-ylsulfonylamino)propanamide
CID 47101384
3-(naphthalen-2-ylsulfonylamino)-N-phenylpropanamide
CID 9340894
N-[3-oxo-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propyl]naphthalene-2-sulfonamide
CID 56550806
4-(naphthalen-2-ylsulfonylamino)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)butanamide
CID 39948497
N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513
N-[3-[2-(aminomethyl)piperidin-1-yl]-3-oxopropyl]naphthalene-2-sulfonamide
CID 119468452
(2S)-2-[3-(naphthalen-2-ylsulfonylamino)propanoylamino]propanoic acid
CID 119238107
3-(naphthalen-2-ylsulfonylamino)-N-piperidin-4-ylpropanamide
CID 119388771
(2S)-1-[3-(naphthalen-2-ylsulfonylamino)propanoyl]pyrrolidine-2-carboxylic acid
CID 119366041
N-[3-[2-(aminomethyl)pyrrolidin-1-yl]-3-oxopropyl]naphthalene-2-sulfonamide
CID 119633298

Frequently Asked Questions

What is the IUPAC name of 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide?
The IUPAC name of 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide (CID 9271723) is 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide.
What is the SMILES notation for 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide?
The canonical SMILES for 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide is O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NN1CCCCC1.
What is the InChIKey of 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide?
The InChIKey is MSYGDRJHHXXSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c22-18(20-21-12-4-1-5-13-21)10-11-19-25(23,24)17-9-8-15-6-2-3-7-16(15)14-17/h2-3,6-9,14,19H,1,4-5,10-13H2,(H,20,22).
What are the key properties of 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide?
3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide has a molecular weight of 361.47 g/mol, XLogP of 2.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(naphthalen-2-ylsulfonylamino)-N-piperidin-1-ylpropanamide is sourced from PubChem (CID 9271723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).