ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine

C10H17N3 — CID 144934481

IUPACethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine
SMILESC=Cc1ncc(N)n1/C=C\C.CC
InChIInChI=1S/C8H11N3.C2H6/c1-3-5-11-7(9)6-10-8(11)4-2;1-2/h3-6H,2,9H2,1H3;1-2H3/b5-3-;
InChIKeyWUSNFPBSTRSMRW-FBZPGIPVSA-N
MW179.27 g/mol
LogP2.63
Rot. Bonds2

About ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine

ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine (PubChem CID 144934481) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine.

Molecular Properties

Compound Nameethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine
PubChem CID144934481
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Nameethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine
SMILESC=Cc1ncc(N)n1/C=C\C.CC
InChIInChI=1S/C8H11N3.C2H6/c1-3-5-11-7(9)6-10-8(11)4-2;1-2/h3-6H,2,9H2,1H3;1-2H3/b5-3-;
InChIKeyWUSNFPBSTRSMRW-FBZPGIPVSA-N
XLogP2.63
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(Z)-2-aminoethenyl]-2-methylimidazol-4-amine;ethane
CID 144655779
ethane;1-ethenyl-5-propan-2-yl-2-[(Z)-prop-1-enyl]imidazole
CID 169268606
3-[(Z)-prop-1-enyl]imidazol-4-amine
CID 170048351
1-ethenyl-5-[(Z)-prop-1-enyl]imidazol-2-amine
CID 118448154
2-ethenyl-5-methyl-1-propylimidazole
CID 135202398
5-bromo-6-chloro-2-ethenyl-3-[(Z)-prop-1-enyl]pyrimidin-4-one
CID 143734143
N-[4-ethenyl-1-[(Z)-prop-1-enyl]pyrazol-5-yl]methanimine
CID 142406766
ethane;2-ethenyl-4-(2-fluoro-4-methylphenyl)-1-[(Z)-prop-1-enyl]imidazole
CID 143545388
1-[(1Z)-buta-1,3-dienyl]-2-ethenylimidazole;ethane
CID 143945087
N-(2-ethenyl-5-propan-2-ylimidazol-1-yl)methanimine
CID 176690534
ethane;5-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]pyridine
CID 143821752
1-(2-ethenyl-3-methylimidazol-4-yl)-N-methylmethanamine
CID 157048519

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine?
The IUPAC name of ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine (CID 144934481) is ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine.
What is the SMILES notation for ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine?
The canonical SMILES for ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine is C=Cc1ncc(N)n1/C=C\C.CC.
What is the InChIKey of ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine?
The InChIKey is WUSNFPBSTRSMRW-FBZPGIPVSA-N. The full InChI is InChI=1S/C8H11N3.C2H6/c1-3-5-11-7(9)6-10-8(11)4-2;1-2/h3-6H,2,9H2,1H3;1-2H3/b5-3-;.
What are the key properties of ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine?
ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine has a molecular weight of 179.27 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethenyl-3-[(Z)-prop-1-enyl]imidazol-4-amine is sourced from PubChem (CID 144934481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).