(Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine

C12H23N3O4 — CID 166139240

IUPAC(Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine
SMILESC#CCOCCOCCOCCOC/C(N)=C/NN
InChIInChI=1S/C12H23N3O4/c1-2-3-16-4-5-17-6-7-18-8-9-19-11-12(13)10-15-14/h1,10,15H,3-9,11,13-14H2/b12-10-
InChIKeyLZYMDKJRJHDZRB-BENRWUELSA-N
MW273.33 g/mol
LogP-1.05
Rot. Bonds13

About (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine

(Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine (PubChem CID 166139240) has the molecular formula C12H23N3O4 and a molecular weight of 273.33 g/mol. Its IUPAC name is (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine
PubChem CID166139240
Molecular FormulaC12H23N3O4
Molecular Weight273.33 g/mol
Exact Mass273.17
IUPAC Name(Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine
SMILESC#CCOCCOCCOCCOC/C(N)=C/NN
InChIInChI=1S/C12H23N3O4/c1-2-3-16-4-5-17-6-7-18-8-9-19-11-12(13)10-15-14/h1,10,15H,3-9,11,13-14H2/b12-10-
InChIKeyLZYMDKJRJHDZRB-BENRWUELSA-N
XLogP-1.05
TPSA100.99 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 5-1.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine?
The IUPAC name of (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine (CID 166139240) is (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine.
What is the SMILES notation for (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine?
The canonical SMILES for (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine is C#CCOCCOCCOCCOC/C(N)=C/NN.
What is the InChIKey of (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine?
The InChIKey is LZYMDKJRJHDZRB-BENRWUELSA-N. The full InChI is InChI=1S/C12H23N3O4/c1-2-3-16-4-5-17-6-7-18-8-9-19-11-12(13)10-15-14/h1,10,15H,3-9,11,13-14H2/b12-10-.
What are the key properties of (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine?
(Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine has a molecular weight of 273.33 g/mol, XLogP of -1.05, 13 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-hydrazinyl-3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-en-2-amine is sourced from PubChem (CID 166139240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).