N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride

C15H21ClN2O2S — CID 120664537

IUPACN-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride
SMILESCCN[C@H](C)CNS(=O)(=O)c1ccc2ccccc2c1.Cl
InChIInChI=1S/C15H20N2O2S.ClH/c1-3-16-12(2)11-17-20(18,19)15-9-8-13-6-4-5-7-14(13)10-15;/h4-10,12,16-17H,3,11H2,1-2H3;1H/t12-;/m1./s1
InChIKeyDISYQQGNHOTUFI-UTONKHPSSA-N
MW328.87 g/mol
LogP2.54
Rot. Bonds6

About N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride

N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride (PubChem CID 120664537) has the molecular formula C15H21ClN2O2S and a molecular weight of 328.87 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride
PubChem CID120664537
Molecular FormulaC15H21ClN2O2S
Molecular Weight328.87 g/mol
Exact Mass328.10
IUPAC NameN-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride
SMILESCCN[C@H](C)CNS(=O)(=O)c1ccc2ccccc2c1.Cl
InChIInChI=1S/C15H20N2O2S.ClH/c1-3-16-12(2)11-17-20(18,19)15-9-8-13-6-4-5-7-14(13)10-15;/h4-10,12,16-17H,3,11H2,1-2H3;1H/t12-;/m1./s1
InChIKeyDISYQQGNHOTUFI-UTONKHPSSA-N
XLogP2.54
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.87
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-(ethylamino)propyl]-3-propan-2-ylbenzenesulfonamide;hydrochloride
CID 120664627
N-(2-hydroxypropyl)naphthalene-2-sulfonamide
CID 43394412
N-[(2R)-2-(ethylamino)propyl]-3-fluorobenzenesulfonamide;hydrochloride
CID 120664651
N-[(2R)-2-(ethylamino)propyl]-4-fluorobenzenesulfonamide;hydrochloride
CID 120664997
N-ethyl-4-naphthalen-2-ylsulfonylpentan-2-amine
CID 64705187
N-[(2S)-1-[[(2R)-butan-2-yl]amino]propan-2-yl]naphthalene-2-sulfonamide
CID 163796605
3-cyano-N-[(2R)-2-(ethylamino)propyl]benzenesulfonamide;hydrochloride
CID 120664547
3-N-cyclopropyl-1-N-[(2R)-2-(ethylamino)propyl]benzene-1,3-disulfonamide;hydrochloride
CID 120664523
N-[(2R)-2-(ethylamino)propyl]-3-fluoro-4-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 120713890
3-bromo-4-ethoxy-N-[(2R)-2-(ethylamino)propyl]benzenesulfonamide;hydrochloride
CID 120664517
3-bromo-N-[(2R)-2-(ethylamino)propyl]-4-nitrobenzenesulfonamide;hydrochloride
CID 120664929
N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride (CID 120664537) is N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride is CCN[C@H](C)CNS(=O)(=O)c1ccc2ccccc2c1.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride?
The InChIKey is DISYQQGNHOTUFI-UTONKHPSSA-N. The full InChI is InChI=1S/C15H20N2O2S.ClH/c1-3-16-12(2)11-17-20(18,19)15-9-8-13-6-4-5-7-14(13)10-15;/h4-10,12,16-17H,3,11H2,1-2H3;1H/t12-;/m1./s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride?
N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride has a molecular weight of 328.87 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride is sourced from PubChem (CID 120664537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).