N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine

C14H30N2S — CID 167115716

IUPACN-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine
SMILESC=CS(C=C)(N(CC)C(C)C)N(CC)C(C)C
InChIInChI=1S/C14H30N2S/c1-9-15(13(5)6)17(11-3,12-4)16(10-2)14(7)8/h11-14H,3-4,9-10H2,1-2,5-8H3
InChIKeyMSUAANBJHGLKFL-UHFFFAOYSA-N
MW258.47 g/mol
LogP4.37
Rot. Bonds8

About N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine

N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine (PubChem CID 167115716) has the molecular formula C14H30N2S and a molecular weight of 258.47 g/mol. Its IUPAC name is N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine.

Molecular Properties

Compound NameN-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine
PubChem CID167115716
Molecular FormulaC14H30N2S
Molecular Weight258.47 g/mol
Exact Mass258.21
IUPAC NameN-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine
SMILESC=CS(C=C)(N(CC)C(C)C)N(CC)C(C)C
InChIInChI=1S/C14H30N2S/c1-9-15(13(5)6)17(11-3,12-4)16(10-2)14(7)8/h11-14H,3-4,9-10H2,1-2,5-8H3
InChIKeyMSUAANBJHGLKFL-UHFFFAOYSA-N
XLogP4.37
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.47
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(trimethyl-λ4-sulfanyl)propan-2-amine
CID 164554404
N-[bis(ethenyl)-[ethyl(methyl)amino]-λ4-sulfanyl]-N-methylethanamine
CID 170209851
N-ethyl-N-[ethyl(dimethyl)-λ4-sulfanyl]pent-4-en-2-amine
CID 123327137
N-ethyl-N-propan-2-ylsulfamoyl chloride
CID 43265685
2-[ethyl(propan-2-yl)sulfamoyl]acetic acid
CID 43265650
2-ethenylsulfonylbutanal
CID 173386551
3-pent-1-en-3-ylsulfonylpent-1-ene
CID 87156214
N-[dihydroxy(7-methyloct-7-en-4-yl)-λ4-sulfanyl]-N-ethylpropan-2-amine
CID 123969566
ethene;N-ethyl-N-methylpropan-2-amine
CID 144977253
2,3-bis(ethenylsulfonyl)butane
CID 158758752
(3S)-2,3-bis(ethenylsulfonyl)butane
CID 159569958
N-ethyl-4-fluoro-N-propan-2-ylbenzenesulfonamide
CID 43453699

Frequently Asked Questions

What is the IUPAC name of N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine?
The IUPAC name of N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine (CID 167115716) is N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine.
What is the SMILES notation for N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine?
The canonical SMILES for N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine is C=CS(C=C)(N(CC)C(C)C)N(CC)C(C)C.
What is the InChIKey of N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine?
The InChIKey is MSUAANBJHGLKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2S/c1-9-15(13(5)6)17(11-3,12-4)16(10-2)14(7)8/h11-14H,3-4,9-10H2,1-2,5-8H3.
What are the key properties of N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine?
N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine has a molecular weight of 258.47 g/mol, XLogP of 4.37, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(ethenyl)-[ethyl(propan-2-yl)amino]-λ4-sulfanyl]-N-ethylpropan-2-amine is sourced from PubChem (CID 167115716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).