N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide

C14H18N2O2S — CID 115752504

IUPACN-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide
SMILESCN(CCCN)S(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C14H18N2O2S/c1-16(11-5-10-15)19(17,18)14-9-4-7-12-6-2-3-8-13(12)14/h2-4,6-9H,5,10-11,15H2,1H3
InChIKeyTZVIOFSHRFYVKN-UHFFFAOYSA-N
MW278.38 g/mol
LogP1.81
Rot. Bonds5

About N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide

N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide (PubChem CID 115752504) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide
PubChem CID115752504
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC NameN-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide
SMILESCN(CCCN)S(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C14H18N2O2S/c1-16(11-5-10-15)19(17,18)14-9-4-7-12-6-2-3-8-13(12)14/h2-4,6-9H,5,10-11,15H2,1H3
InChIKeyTZVIOFSHRFYVKN-UHFFFAOYSA-N
XLogP1.81
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-methylnaphthalene-1-sulfonamide;hydrochloride
CID 174226998
4-[methyl(naphthalen-1-ylsulfonyl)amino]butanoic acid
CID 115776536
N-(6-aminohexyl)-N-chloronaphthalene-1-sulfonamide
CID 139649368
N'-hydroxy-3-[methyl(naphthalen-1-ylsulfonyl)amino]propanimidamide
CID 114795590
N-(2-hydroxypropyl)-N-methylnaphthalene-1-sulfonamide
CID 115902788
N-methyl-N-propan-2-ylnaphthalene-1-sulfonamide
CID 21131549
1-N,5-N-dimethyl-1-N,5-N-dipropylnaphthalene-1,5-disulfonamide
CID 54492944
N-(2-aminoethyl)-2-bromo-N-methylbenzenesulfonamide
CID 62688610
N,N-dimethyl-2-[methyl(naphthalen-1-ylsulfonyl)amino]acetamide
CID 115684021
N-propan-2-ylnaphthalene-1-sulfonohydrazide
CID 141255188
N-(3-aminopropyl)-2,3,4-trifluoro-N-methylbenzenesulfonamide
CID 115319073
N-(1,3-dioxolan-2-ylmethyl)-N-methylnaphthalene-1-sulfonamide
CID 4994619

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide?
The IUPAC name of N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide (CID 115752504) is N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide is CN(CCCN)S(=O)(=O)c1cccc2ccccc12.
What is the InChIKey of N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide?
The InChIKey is TZVIOFSHRFYVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-16(11-5-10-15)19(17,18)14-9-4-7-12-6-2-3-8-13(12)14/h2-4,6-9H,5,10-11,15H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide?
N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide has a molecular weight of 278.38 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methylnaphthalene-1-sulfonamide is sourced from PubChem (CID 115752504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).