ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine

C12H24N2 — CID 142390763

IUPACethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine
SMILESC=C/C=C1/CCN/C1=C/C.CC.CN
InChIInChI=1S/C9H13N.C2H6.CH5N/c1-3-5-8-6-7-10-9(8)4-2;2*1-2/h3-5,10H,1,6-7H2,2H3;1-2H3;2H2,1H3/b8-5-,9-4+;;
InChIKeyJJTODGBWZFIBOV-YEGOJRHASA-N
MW196.34 g/mol
LogP2.60
Rot. Bonds1

About ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine

ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine (PubChem CID 142390763) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine.

Molecular Properties

Compound Nameethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine
PubChem CID142390763
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Nameethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine
SMILESC=C/C=C1/CCN/C1=C/C.CC.CN
InChIInChI=1S/C9H13N.C2H6.CH5N/c1-3-5-8-6-7-10-9(8)4-2;2*1-2/h3-5,10H,1,6-7H2,2H3;1-2H3;2H2,1H3/b8-5-,9-4+;;
InChIKeyJJTODGBWZFIBOV-YEGOJRHASA-N
XLogP2.60
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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(Z,3Z)-7-fluoro-7-methyl-N-prop-1-en-2-yl-3-prop-2-enylideneoct-4-en-1-amine
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N-[(Z)-5-fluorohex-3-enyl]-4-methylcyclopenta-1,3-dien-1-amine
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(1E,3E,5E)-8-N-[(2E)-2-ethenyl-4-fluoropenta-2,4-dienyl]-1-N,2,3,6-tetramethylnona-1,3,5,8-tetraene-1,8-diamine
CID 137465227
(3E,4Z)-N-butyl-3-ethylidene-6-fluorohepta-1,4,6-trien-2-amine
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(5Z)-5-(fluoromethylidene)-4-[(3E)-hexa-1,3,5-trien-3-yl]-1,2-dihydropyrrole
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CID 153577901
(2Z,4E)-4-(difluoromethyl)-N-(4-methylpenta-1,4-dien-2-yl)hexa-2,4-dien-1-amine
CID 166907459
(3E,5Z)-3-fluoro-4-methyl-2-methylidene-N-pent-1-en-2-ylhepta-3,5-dien-1-amine
CID 167170063
4-fluoro-2-[(1E)-1-pyrrolidin-2-ylideneethyl]cyclohexa-1,3-dien-1-amine
CID 170151721
(4E,6Z)-5-N-fluoro-1-N-methyl-5-N-[(3Z,5Z)-4-methylhepta-3,5-dienyl]octa-4,6-diene-1,5-diamine
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Frequently Asked Questions

What is the IUPAC name of ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine?
The IUPAC name of ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine (CID 142390763) is ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine.
What is the SMILES notation for ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine?
The canonical SMILES for ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine is C=C/C=C1/CCN/C1=C/C.CC.CN.
What is the InChIKey of ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine?
The InChIKey is JJTODGBWZFIBOV-YEGOJRHASA-N. The full InChI is InChI=1S/C9H13N.C2H6.CH5N/c1-3-5-8-6-7-10-9(8)4-2;2*1-2/h3-5,10H,1,6-7H2,2H3;1-2H3;2H2,1H3/b8-5-,9-4+;;.
What are the key properties of ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine?
ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine has a molecular weight of 196.34 g/mol, XLogP of 2.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyrrolidine;methanamine is sourced from PubChem (CID 142390763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).