(1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine

C15H25N5 — CID 143922563

IUPAC(1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine
SMILESC=C(N)/N=C(\C=C/C)C(=CN)/C(C)=C(/C=C\N)N(C)C
InChIInChI=1S/C15H25N5/c1-6-7-14(19-12(3)18)13(10-17)11(2)15(8-9-16)20(4)5/h6-10H,3,16-18H2,1-2,4-5H3/b7-6-,9-8-,13-10+,15-11-,19-14+
InChIKeyHJOWDUBQQDTOQS-RIVLFYERSA-N
MW275.40 g/mol
LogP1.58
Rot. Bonds6

About (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine

(1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine (PubChem CID 143922563) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine.

Molecular Properties

Compound Name(1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine
PubChem CID143922563
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name(1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine
SMILESC=C(N)/N=C(\C=C/C)C(=CN)/C(C)=C(/C=C\N)N(C)C
InChIInChI=1S/C15H25N5/c1-6-7-14(19-12(3)18)13(10-17)11(2)15(8-9-16)20(4)5/h6-10H,3,16-18H2,1-2,4-5H3/b7-6-,9-8-,13-10+,15-11-,19-14+
InChIKeyHJOWDUBQQDTOQS-RIVLFYERSA-N
XLogP1.58
TPSA93.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-3-amino-N-(1-aminoethenyl)prop-2-enimidoyl chloride
CID 173022754
(1Z)-4-ethenyl-3-N,3-N-dimethylhexa-1,3,5-triene-1,3-diamine
CID 130248294
(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine
CID 173482086
N-[(1E,4Z)-1-amino-2-methylhexa-1,4-dien-3-ylidene]methanimidamide
CID 90452898
(E)-N'-aminobut-2-enimidamide
CID 142083872
(2Z,4E)-7-methylocta-2,4,7-trien-4-amine
CID 89010551
(1Z,4Z)-1-aminohexa-1,4-dien-3-one
CID 143438957
(1Z,3Z)-2-methyl-1-(methylideneamino)penta-1,3-dien-1-amine
CID 142933164
(1Z,3Z,6E)-5-methylideneocta-1,3,6-trien-1-amine
CID 89470665
(3E)-N-methyl-N-propan-2-ylpenta-1,3-dien-2-amine
CID 130272029
(3Z,5E)-2-N,2-N-dimethylhepta-1,3,5-triene-2,5-diamine
CID 134313131
ethane;(3E,5Z)-4-methylhepta-1,3,5-trien-2-amine
CID 143375975

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine?
The IUPAC name of (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine (CID 143922563) is (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine.
What is the SMILES notation for (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine?
The canonical SMILES for (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine is C=C(N)/N=C(\C=C/C)C(=CN)/C(C)=C(/C=C\N)N(C)C.
What is the InChIKey of (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine?
The InChIKey is HJOWDUBQQDTOQS-RIVLFYERSA-N. The full InChI is InChI=1S/C15H25N5/c1-6-7-14(19-12(3)18)13(10-17)11(2)15(8-9-16)20(4)5/h6-10H,3,16-18H2,1-2,4-5H3/b7-6-,9-8-,13-10+,15-11-,19-14+.
What are the key properties of (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine?
(1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine has a molecular weight of 275.40 g/mol, XLogP of 1.58, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z,5E)-5-[(E)-N-(1-aminoethenyl)-C-[(Z)-prop-1-enyl]carbonimidoyl]-3-N,3-N,4-trimethylhexa-1,3,5-triene-1,3,6-triamine is sourced from PubChem (CID 143922563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).