1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten

C15H25N3W — CID 142064434

IUPAC1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten
SMILESC/C=C\C1=C(CC)CCCC(NC(=[W])CC)/C1=N\N
InChIInChI=1S/C15H25N3.W/c1-4-8-13-12(6-3)9-7-10-14(15(13)18-16)17-11-5-2;/h4,8,14,17H,5-7,9-10,16H2,1-3H3;/b8-4-,18-15-;
InChIKeyXPWMUXKKMKCXJU-POQZXBKCSA-N
MW431.23 g/mol
LogP2.81
Rot. Bonds5

About 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten

1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten (PubChem CID 142064434) has the molecular formula C15H25N3W and a molecular weight of 431.23 g/mol. Its IUPAC name is 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten.

Molecular Properties

Compound Name1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten
PubChem CID142064434
Molecular FormulaC15H25N3W
Molecular Weight431.23 g/mol
Exact Mass431.16
IUPAC Name1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten
SMILESC/C=C\C1=C(CC)CCCC(NC(=[W])CC)/C1=N\N
InChIInChI=1S/C15H25N3.W/c1-4-8-13-12(6-3)9-7-10-14(15(13)18-16)17-11-5-2;/h4,8,14,17H,5-7,9-10,16H2,1-3H3;/b8-4-,18-15-;
InChIKeyXPWMUXKKMKCXJU-POQZXBKCSA-N
XLogP2.81
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.23
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-N-ethyl-6-imino-8-methylnon-7-ene-1,5-diamine
CID 91539250
(7Z,9E)-7-ethyl-6-methylidene-4-methylimino-N-propan-2-yldodeca-7,9-dien-3-amine
CID 130374413
1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten;2-methylpropane
CID 142064433
3-imino-N,11-dimethyldodec-10-en-2-amine
CID 155364759
(3Z,5Z)-7-imino-N,3-dimethylcycloocta-3,5-dien-1-amine
CID 156227160
2-imino-3-(6-methylhept-6-enyl)-5-methylidene-N-propylcyclohex-3-en-1-amine
CID 163746263
(4E)-N-ethyl-2-methyl-4-[N-methyl-C-[(3E)-1-methyl-2-methyliminohexa-3,5-dienehydrazonoyl]carbonimidoyl]hepta-4,6-dien-3-amine
CID 173986226
2-imino-N-methyl-2-[(1Z,11Z)-2-methylcyclododeca-1,9,11-trien-1-yl]ethanamine
CID 144189499
1-(6-Ethyl-1,2,3,6-tetrahydropyridin-5-yl)butan-1-imine
CID 176943094

Frequently Asked Questions

What is the IUPAC name of 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten?
The IUPAC name of 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten (CID 142064434) is 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten.
What is the SMILES notation for 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten?
The canonical SMILES for 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten is C/C=C\C1=C(CC)CCCC(NC(=[W])CC)/C1=N\N.
What is the InChIKey of 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten?
The InChIKey is XPWMUXKKMKCXJU-POQZXBKCSA-N. The full InChI is InChI=1S/C15H25N3.W/c1-4-8-13-12(6-3)9-7-10-14(15(13)18-16)17-11-5-2;/h4,8,14,17H,5-7,9-10,16H2,1-3H3;/b8-4-,18-15-;.
What are the key properties of 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten?
1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten has a molecular weight of 431.23 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2Z)-4-ethyl-2-hydrazinylidene-3-[(Z)-prop-1-enyl]cyclohept-3-en-1-yl]amino]propylidenetungsten is sourced from PubChem (CID 142064434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).