(Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine

C8H15NS — CID 177320214

IUPAC(Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine
SMILESC/C=C(/C)S/C(=C\C)CN
InChIInChI=1S/C8H15NS/c1-4-7(3)10-8(5-2)6-9/h4-5H,6,9H2,1-3H3/b7-4-,8-5-
InChIKeyIYKFWOGBHSCXRY-IUNAMMOKSA-N
MW157.28 g/mol
LogP2.51
Rot. Bonds3

About (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine

(Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine (PubChem CID 177320214) has the molecular formula C8H15NS and a molecular weight of 157.28 g/mol. Its IUPAC name is (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine.

Molecular Properties

Compound Name(Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine
PubChem CID177320214
Molecular FormulaC8H15NS
Molecular Weight157.28 g/mol
Exact Mass157.09
IUPAC Name(Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine
SMILESC/C=C(/C)S/C(=C\C)CN
InChIInChI=1S/C8H15NS/c1-4-7(3)10-8(5-2)6-9/h4-5H,6,9H2,1-3H3/b7-4-,8-5-
InChIKeyIYKFWOGBHSCXRY-IUNAMMOKSA-N
XLogP2.51
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(Z)-1-aminobut-2-en-2-yl]sulfanylmethanimidoyl iodide
CID 163502929
ethane;(E)-2-methylbut-2-en-1-amine
CID 143126419
(E)-2-buta-1,3-dien-2-ylsulfanylbut-2-ene
CID 145179900
2-[(Z)-but-2-en-2-yl]sulfanyl-3-methylbut-1-ene
CID 155737131
(Z)-N-methyl-2-methylsulfanylprop-1-ene-1,3-diamine
CID 145277623
1-[(Z)-pent-2-en-3-yl]sulfanylethenamine
CID 171562987
(E)-2,3-dimethylbut-2-ene-1,4-diamine
CID 55291095
S-[(E)-1-chlorobut-2-en-2-yl]thiohydroxylamine
CID 163721113
(E)-4-methylhex-4-en-1-amine
CID 55285525
(E)-2-methyl-1-[(E)-2-methylbut-2-enyl]sulfanylbut-2-ene
CID 19352987
2-chlorobut-2-en-1-amine
CID 123970893
1-acetylsulfanylethylideneazanium
CID 172859832

Frequently Asked Questions

What is the IUPAC name of (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine?
The IUPAC name of (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine (CID 177320214) is (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine.
What is the SMILES notation for (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine?
The canonical SMILES for (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine is C/C=C(/C)S/C(=C\C)CN.
What is the InChIKey of (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine?
The InChIKey is IYKFWOGBHSCXRY-IUNAMMOKSA-N. The full InChI is InChI=1S/C8H15NS/c1-4-7(3)10-8(5-2)6-9/h4-5H,6,9H2,1-3H3/b7-4-,8-5-.
What are the key properties of (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine?
(Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine has a molecular weight of 157.28 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[(Z)-but-2-en-2-yl]sulfanylbut-2-en-1-amine is sourced from PubChem (CID 177320214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).