(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane

C11H25NS — CID 143858939

IUPAC(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane
SMILESC/C=C(/CCCN(C)C)SC.CC
InChIInChI=1S/C9H19NS.C2H6/c1-5-9(11-4)7-6-8-10(2)3;1-2/h5H,6-8H2,1-4H3;1-2H3/b9-5-;
InChIKeyFPYDYUYNPIPFLW-UYTGOYFPSA-N
MW203.39 g/mol
LogP3.62
Rot. Bonds5

About (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane

(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane (PubChem CID 143858939) has the molecular formula C11H25NS and a molecular weight of 203.39 g/mol. Its IUPAC name is (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane.

Molecular Properties

Compound Name(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane
PubChem CID143858939
Molecular FormulaC11H25NS
Molecular Weight203.39 g/mol
Exact Mass203.17
IUPAC Name(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane
SMILESC/C=C(/CCCN(C)C)SC.CC
InChIInChI=1S/C9H19NS.C2H6/c1-5-9(11-4)7-6-8-10(2)3;1-2/h5H,6-8H2,1-4H3;1-2H3/b9-5-;
InChIKeyFPYDYUYNPIPFLW-UYTGOYFPSA-N
XLogP3.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.39
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

(Z)-N-ethyl-3-ethylsulfanyl-N-methylpent-3-en-1-amine
CID 118617237
(4E,6Z)-N,N-dimethyl-7-methylsulfanylhepta-4,6-dien-1-amine;ethene
CID 142806868
(Z)-N,N,3-trimethyl-4-methylsulfanylhept-4-en-1-amine
CID 143782135
ethane;(Z)-3-ethylsulfanyl-N-methyl-N-propylpent-3-en-1-amine
CID 145444632
N,N-dibutyl-3-methylsulfanylcyclopent-3-en-1-amine
CID 163863912
ethyl-[2-[(Z)-hex-2-en-3-yl]sulfanylethyl]-dipropylazanium
CID 166750025
N-butyl-N-methyl-3-methylsulfanylbut-3-en-1-amine
CID 169926096
5-methylsulfanyl-1-propyl-3,6-dihydro-2H-pyridine
CID 173430912
(Z)-N-methyl-4-methylsulfanylhex-4-en-1-amine
CID 142604435
(4E,6Z)-N,N-dimethyl-7-methylsulfanylhepta-4,6-dien-1-amine
CID 142806869
(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine
CID 143858940
(Z)-3-ethylsulfanyl-N-methyl-N-propylpent-3-en-1-amine
CID 145444633

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane?
The IUPAC name of (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane (CID 143858939) is (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane.
What is the SMILES notation for (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane?
The canonical SMILES for (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane is C/C=C(/CCCN(C)C)SC.CC.
What is the InChIKey of (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane?
The InChIKey is FPYDYUYNPIPFLW-UYTGOYFPSA-N. The full InChI is InChI=1S/C9H19NS.C2H6/c1-5-9(11-4)7-6-8-10(2)3;1-2/h5H,6-8H2,1-4H3;1-2H3/b9-5-;.
What are the key properties of (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane?
(Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane has a molecular weight of 203.39 g/mol, XLogP of 3.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N-dimethyl-4-methylsulfanylhex-4-en-1-amine;ethane is sourced from PubChem (CID 143858939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).