(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane

C10H19NS — CID 142056566

IUPAC(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane
SMILESC=C1CCS/C1=C/N(C)C.CC
InChIInChI=1S/C8H13NS.C2H6/c1-7-4-5-10-8(7)6-9(2)3;1-2/h6H,1,4-5H2,2-3H3;1-2H3/b8-6+;
InChIKeyZXRSGXCCDQHWBI-WVLIHFOGSA-N
MW185.34 g/mol
LogP3.11
Rot. Bonds1

About (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane

(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane (PubChem CID 142056566) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane.

Molecular Properties

Compound Name(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane
PubChem CID142056566
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane
SMILESC=C1CCS/C1=C/N(C)C.CC
InChIInChI=1S/C8H13NS.C2H6/c1-7-4-5-10-8(7)6-9(2)3;1-2/h6H,1,4-5H2,2-3H3;1-2H3/b8-6+;
InChIKeyZXRSGXCCDQHWBI-WVLIHFOGSA-N
XLogP3.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1Z)-N,N-dimethyl-1-[(2S)-2-methyl-5-methylidenecyclopentylidene]methanamine;ethane
CID 178040575
2-(dimethylaminomethylidene)-6-methyl-3-methylidenecyclohexan-1-one
CID 123735445
(1E)-1-(1-tert-butyl-2,4-dimethylidenepyrrolidin-3-ylidene)-N,N-dimethylmethanamine
CID 166788680
2-ethylidene-3-prop-2-enylidenethiolane
CID 123580390
6,7-bis(ethenyl)-2,3,4,5-tetrahydrothiepine;ethane
CID 145445836
(2Z)-2-(dimethylaminomethylidene)-4-methylcyclohexan-1-one
CID 63706279
(2E)-2-(dimethylaminomethylidene)-4-prop-2-enylcyclohexane-1,3-dione
CID 66669177
(2E)-2-(dimethylaminomethylidene)-4-methyl-4H-thiochromen-3-one
CID 10059891
3,3-dimethyl-2-methylidenethiolane
CID 142382826
ethane;(1Z)-1-ethylidene-2,3-dimethylidenecyclopentane
CID 143020945
(2E)-2-[(Z)-but-2-enylidene]-3-methylidenethiomorpholine
CID 142054803
(5E)-3-acetyl-5-(dimethylaminomethylidene)-4-hydroxythiophen-2-one
CID 177450500

Frequently Asked Questions

What is the IUPAC name of (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane?
The IUPAC name of (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane (CID 142056566) is (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane.
What is the SMILES notation for (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane?
The canonical SMILES for (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane is C=C1CCS/C1=C/N(C)C.CC.
What is the InChIKey of (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane?
The InChIKey is ZXRSGXCCDQHWBI-WVLIHFOGSA-N. The full InChI is InChI=1S/C8H13NS.C2H6/c1-7-4-5-10-8(7)6-9(2)3;1-2/h6H,1,4-5H2,2-3H3;1-2H3/b8-6+;.
What are the key properties of (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane?
(1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane has a molecular weight of 185.34 g/mol, XLogP of 3.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-N,N-dimethyl-1-(3-methylidenethiolan-2-ylidene)methanamine;ethane is sourced from PubChem (CID 142056566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).