N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine

C11H19NOS — CID 143530438

IUPACN,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine
SMILESCCN(CC)C(CSC)c1ccco1
InChIInChI=1S/C11H19NOS/c1-4-12(5-2)10(9-14-3)11-7-6-8-13-11/h6-8,10H,4-5,9H2,1-3H3
InChIKeyLVJVIOPBCSRQDY-UHFFFAOYSA-N
MW213.35 g/mol
LogP3.03
Rot. Bonds6

About N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine

N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine (PubChem CID 143530438) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine.

Molecular Properties

Compound NameN,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine
PubChem CID143530438
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC NameN,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine
SMILESCCN(CC)C(CSC)c1ccco1
InChIInChI=1S/C11H19NOS/c1-4-12(5-2)10(9-14-3)11-7-6-8-13-11/h6-8,10H,4-5,9H2,1-3H3
InChIKeyLVJVIOPBCSRQDY-UHFFFAOYSA-N
XLogP3.03
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(furan-2-yl)-N-propylethane-1,2-diamine
CID 43268649
2-[4-[2-[[2-(diethylamino)-2-(furan-2-yl)ethyl]amino]-2-oxoethyl]piperazin-1-yl]-N-ethylacetamide
CID 55823292
[1-(furan-2-yl)-2-methylsulfanylethyl]hydrazine
CID 105213750
1-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-methyl-3-(3-methylbutyl)guanidine
CID 110977065
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-(4-ethoxyphenyl)sulfanylacetamide
CID 55462976
1-tert-butyl-2-[2-(diethylamino)-2-(furan-2-yl)ethyl]-3-ethylguanidine
CID 110964281
(2R)-N-[(2S)-2-(diethylamino)-2-(furan-2-yl)ethyl]-2-pyrimidin-2-ylsulfanylpropanamide
CID 94816743
4-cyano-N-[2-(diethylamino)-2-(furan-2-yl)ethyl]benzenesulfonamide
CID 60602634
1-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-methyl-3-(3,3,3-trifluoropropyl)guanidine;hydroiodide
CID 109473360
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-(2,4,4-trimethylpentan-2-ylamino)acetamide
CID 71933658
N-ethyl-1-(furan-2-yl)-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
CID 61433626
2-[2-(diethylamino)-2-(furan-2-yl)ethyl]-1-(1-methoxypropan-2-yl)guanidine;hydroiodide
CID 111078422

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine?
The IUPAC name of N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine (CID 143530438) is N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine.
What is the SMILES notation for N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine?
The canonical SMILES for N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine is CCN(CC)C(CSC)c1ccco1.
What is the InChIKey of N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine?
The InChIKey is LVJVIOPBCSRQDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-4-12(5-2)10(9-14-3)11-7-6-8-13-11/h6-8,10H,4-5,9H2,1-3H3.
What are the key properties of N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine?
N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine has a molecular weight of 213.35 g/mol, XLogP of 3.03, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(furan-2-yl)-2-methylsulfanylethanamine is sourced from PubChem (CID 143530438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).