(Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine

C8H15NS — CID 154965460

IUPAC(Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine
SMILESC=CS/C(=C\CC)CNC
InChIInChI=1S/C8H15NS/c1-4-6-8(7-9-3)10-5-2/h5-6,9H,2,4,7H2,1,3H3/b8-6-
InChIKeyAOSXCRFPXIMBOT-VURMDHGXSA-N
MW157.28 g/mol
LogP2.38
Rot. Bonds5

About (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine

(Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine (PubChem CID 154965460) has the molecular formula C8H15NS and a molecular weight of 157.28 g/mol. Its IUPAC name is (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine.

Molecular Properties

Compound Name(Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine
PubChem CID154965460
Molecular FormulaC8H15NS
Molecular Weight157.28 g/mol
Exact Mass157.09
IUPAC Name(Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine
SMILESC=CS/C(=C\CC)CNC
InChIInChI=1S/C8H15NS/c1-4-6-8(7-9-3)10-5-2/h5-6,9H,2,4,7H2,1,3H3/b8-6-
InChIKeyAOSXCRFPXIMBOT-VURMDHGXSA-N
XLogP2.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.28
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine?
The IUPAC name of (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine (CID 154965460) is (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine.
What is the SMILES notation for (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine?
The canonical SMILES for (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine is C=CS/C(=C\CC)CNC.
What is the InChIKey of (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine?
The InChIKey is AOSXCRFPXIMBOT-VURMDHGXSA-N. The full InChI is InChI=1S/C8H15NS/c1-4-6-8(7-9-3)10-5-2/h5-6,9H,2,4,7H2,1,3H3/b8-6-.
What are the key properties of (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine?
(Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine has a molecular weight of 157.28 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethenylsulfanyl-N-methylpent-2-en-1-amine is sourced from PubChem (CID 154965460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).