azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine

C10H20N2OS — CID 21285273

IUPACazane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine
SMILESCCSCc1ccc(CN(C)C)o1.N
InChIInChI=1S/C10H17NOS.H3N/c1-4-13-8-10-6-5-9(12-10)7-11(2)3;/h5-6H,4,7-8H2,1-3H3;1H3
InChIKeyHNNYPZAQZCQWCQ-UHFFFAOYSA-N
MW216.35 g/mol
LogP2.76
Rot. Bonds5

About azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine

azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine (PubChem CID 21285273) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Nameazane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine
PubChem CID21285273
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Nameazane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine
SMILESCCSCc1ccc(CN(C)C)o1.N
InChIInChI=1S/C10H17NOS.H3N/c1-4-13-8-10-6-5-9(12-10)7-11(2)3;/h5-6H,4,7-8H2,1-3H3;1H3
InChIKeyHNNYPZAQZCQWCQ-UHFFFAOYSA-N
XLogP2.76
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-N,4-N-bis[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1,2,5-oxadiazole-3,4-diamine
CID 14434275
1-[5-(2-imidazolidin-1-ylethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine
CID 67865220
3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4-N-ethyl-1-oxo-1,2,5-thiadiazole-3,4-diamine
CID 15961201
N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-5-methylpyrimidin-2-amine
CID 72886323
1-[5-(chloromethyl)furan-2-yl]-N,N-dimethylmethanamine;hypochlorous acid
CID 160653099
2-[4-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]butyl]isoindole-1,3-dione
CID 23452155
N-cyano-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]methanimidamide
CID 10801728
N-[[5-(2-aminoethylsulfanylmethyl)furan-2-yl]methyl]-N-methylhydroxylamine;dihydrochloride
CID 131712297
5-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1,2,4-oxadiazole-3,5-diamine
CID 13486642
1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-3-methylpyrrolidine-2,5-dione
CID 134149165
3-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethylamino]-4-methoxycyclobut-3-ene-1,2-dione
CID 21283053
3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4-N-octyl-1-oxo-1,2,5-thiadiazole-3,4-diamine
CID 15959505

Frequently Asked Questions

What is the IUPAC name of azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine?
The IUPAC name of azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine (CID 21285273) is azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine?
The canonical SMILES for azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine is CCSCc1ccc(CN(C)C)o1.N.
What is the InChIKey of azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine?
The InChIKey is HNNYPZAQZCQWCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS.H3N/c1-4-13-8-10-6-5-9(12-10)7-11(2)3;/h5-6H,4,7-8H2,1-3H3;1H3.
What are the key properties of azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine?
azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine has a molecular weight of 216.35 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1-[5-(ethylsulfanylmethyl)furan-2-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 21285273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).