N-benzylsulfinamoylpropan-1-amine

C10H16N2OS — CID 134182870

IUPACN-benzylsulfinamoylpropan-1-amine
SMILESCCCNS(=O)NCc1ccccc1
InChIInChI=1S/C10H16N2OS/c1-2-8-11-14(13)12-9-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3
InChIKeyHYFCKTZGYFFGJR-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.35
Rot. Bonds6

About N-benzylsulfinamoylpropan-1-amine

N-benzylsulfinamoylpropan-1-amine (PubChem CID 134182870) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-benzylsulfinamoylpropan-1-amine.

Molecular Properties

Compound NameN-benzylsulfinamoylpropan-1-amine
PubChem CID134182870
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-benzylsulfinamoylpropan-1-amine
SMILESCCCNS(=O)NCc1ccccc1
InChIInChI=1S/C10H16N2OS/c1-2-8-11-14(13)12-9-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3
InChIKeyHYFCKTZGYFFGJR-UHFFFAOYSA-N
XLogP1.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzylpropan-1-amine;ethane;propane
CID 145164103
N-benzylpropan-1-amine;nitromethane
CID 90801656
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CID 108940601
(2E)-N-benzyl-5-methylhexa-2,4-diene-3-sulfinamide
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2-(benzylamino)-3-(propylamino)naphthalene-1,4-dione
CID 20725728
1-benzyl-3-propylthiourea
CID 12725927
azane;N-benzylbutan-1-amine
CID 175388745
N-benzyl-4-oxoazetidine-2-sulfinamide
CID 151417674
N-(benzylsulfamoyl)butan-1-amine
CID 15569640
1-phenyl-N-(propoxymethyl)methanamine
CID 122494011
N-benzyltridecan-1-amine;hydrochloride
CID 173249552
N-benzylbutan-1-amine;ethane;ethene
CID 143478756

Frequently Asked Questions

What is the IUPAC name of N-benzylsulfinamoylpropan-1-amine?
The IUPAC name of N-benzylsulfinamoylpropan-1-amine (CID 134182870) is N-benzylsulfinamoylpropan-1-amine.
What is the SMILES notation for N-benzylsulfinamoylpropan-1-amine?
The canonical SMILES for N-benzylsulfinamoylpropan-1-amine is CCCNS(=O)NCc1ccccc1.
What is the InChIKey of N-benzylsulfinamoylpropan-1-amine?
The InChIKey is HYFCKTZGYFFGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-2-8-11-14(13)12-9-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3.
What are the key properties of N-benzylsulfinamoylpropan-1-amine?
N-benzylsulfinamoylpropan-1-amine has a molecular weight of 212.32 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzylsulfinamoylpropan-1-amine is sourced from PubChem (CID 134182870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).