N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine

C19H30N2O2S — CID 134074302

IUPACN,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine
SMILESCCCS(=O)(=O)N1CCC2(CCC(N(C)C)c3ccccc32)CC1
InChIInChI=1S/C19H30N2O2S/c1-4-15-24(22,23)21-13-11-19(12-14-21)10-9-18(20(2)3)16-7-5-6-8-17(16)19/h5-8,18H,4,9-15H2,1-3H3
InChIKeyNPCNDDIYDQPOLD-UHFFFAOYSA-N
MW350.53 g/mol
LogP3.16
Rot. Bonds4

About N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine

N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine (PubChem CID 134074302) has the molecular formula C19H30N2O2S and a molecular weight of 350.53 g/mol. Its IUPAC name is N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine
PubChem CID134074302
Molecular FormulaC19H30N2O2S
Molecular Weight350.53 g/mol
Exact Mass350.20
IUPAC NameN,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine
SMILESCCCS(=O)(=O)N1CCC2(CCC(N(C)C)c3ccccc32)CC1
InChIInChI=1S/C19H30N2O2S/c1-4-15-24(22,23)21-13-11-19(12-14-21)10-9-18(20(2)3)16-7-5-6-8-17(16)19/h5-8,18H,4,9-15H2,1-3H3
InChIKeyNPCNDDIYDQPOLD-UHFFFAOYSA-N
XLogP3.16
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.53
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(dimethylamino)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-carboxamide
CID 131656953
2-(1'-ethylsulfonylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)-N,N-dimethylacetamide
CID 131646499
N,N-dimethylspiro[2,3-dihydro-1H-naphthalene-4,4'-oxane]-1-amine
CID 175972405
1'-butylsulfonylspiro[1,2-dihydroindene-3,4'-piperidine]
CID 163880046
N,N-dimethyl-1'-[(1-methylpyrazol-4-yl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine
CID 134079367
1-methyl-1'-methylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
CID 134073260
N,N-diethyl-2-(1'-ethylsulfonylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide
CID 131651770
1-(benzenesulfonyl)-4-propylsulfonylpiperazine
CID 719624
(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine
CID 97400348
2-propylsulfonylspiro[1,3-dihydroisoquinoline-4,1'-cyclohexane]
CID 110667496
1-phenyl-N-(1-propylsulfonylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 55962295
N-methyl-2-[1'-(2-methylpropylsulfonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131658314

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine?
The IUPAC name of N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine (CID 134074302) is N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine.
What is the SMILES notation for N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine?
The canonical SMILES for N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine is CCCS(=O)(=O)N1CCC2(CCC(N(C)C)c3ccccc32)CC1.
What is the InChIKey of N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine?
The InChIKey is NPCNDDIYDQPOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2S/c1-4-15-24(22,23)21-13-11-19(12-14-21)10-9-18(20(2)3)16-7-5-6-8-17(16)19/h5-8,18H,4,9-15H2,1-3H3.
What are the key properties of N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine?
N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine has a molecular weight of 350.53 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1'-propylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-amine is sourced from PubChem (CID 134074302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).