2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine

C9H22N4O2 — CID 159059543

IUPAC2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine
SMILESCOCCC(C#N)(CN)CCOC.NN
InChIInChI=1S/C9H18N2O2.H4N2/c1-12-5-3-9(7-10,8-11)4-6-13-2;1-2/h3-7,10H2,1-2H3;1-2H2
InChIKeyJYHASJAGZGIYFL-UHFFFAOYSA-N
MW218.30 g/mol
LogP-0.65
Rot. Bonds7

About 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine

2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine (PubChem CID 159059543) has the molecular formula C9H22N4O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine.

Molecular Properties

Compound Name2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine
PubChem CID159059543
Molecular FormulaC9H22N4O2
Molecular Weight218.30 g/mol
Exact Mass218.17
IUPAC Name2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine
SMILESCOCCC(C#N)(CN)CCOC.NN
InChIInChI=1S/C9H18N2O2.H4N2/c1-12-5-3-9(7-10,8-11)4-6-13-2;1-2/h3-7,10H2,1-2H3;1-2H2
InChIKeyJYHASJAGZGIYFL-UHFFFAOYSA-N
XLogP-0.65
TPSA120.31 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethyl)-2-prop-2-enylpent-4-enenitrile
CID 174183391
2-[2-(2-methoxyethoxy)ethyl]-2-prop-2-enylpent-4-enenitrile
CID 174183378
2-bromo-4-methoxy-2-methylbutanenitrile
CID 83090478
2,4-dimethoxy-2-methylbutanenitrile
CID 66072771
3-methoxy-2,2-bis(methoxymethyl)propanenitrile
CID 86219819
2-(2-methoxyethyl)-2-methylbut-3-en-1-amine
CID 102640309
2-cyanoethyl 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanoate
CID 150676508
2-(aminomethyl)-2-prop-2-enylpent-4-enenitrile
CID 57269816
1,5-dimethoxy-3-methylpentan-3-amine
CID 114997128
4-(2-methoxyethyl)hepta-1,6-dien-4-amine;hydrochloride
CID 17365761
2-amino-5-[3-(2-methoxyethoxy)propoxy]-2-methylpentanenitrile
CID 103404479
N-(2-cyano-4-methoxybutan-2-yl)acetamide
CID 166604136

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine?
The IUPAC name of 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine (CID 159059543) is 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine.
What is the SMILES notation for 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine?
The canonical SMILES for 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine is COCCC(C#N)(CN)CCOC.NN.
What is the InChIKey of 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine?
The InChIKey is JYHASJAGZGIYFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2.H4N2/c1-12-5-3-9(7-10,8-11)4-6-13-2;1-2/h3-7,10H2,1-2H3;1-2H2.
What are the key properties of 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine?
2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine has a molecular weight of 218.30 g/mol, XLogP of -0.65, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-methoxy-2-(2-methoxyethyl)butanenitrile;hydrazine is sourced from PubChem (CID 159059543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).