ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine

C9H23N3O — CID 169146501

IUPACethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine
SMILESCC.CC(C)(C)OC/C(N)=C/NN
InChIInChI=1S/C7H17N3O.C2H6/c1-7(2,3)11-5-6(8)4-10-9;1-2/h4,10H,5,8-9H2,1-3H3;1-2H3/b6-4-;
InChIKeyDFFUVBTVJDENOE-YHSAGPEESA-N
MW189.30 g/mol
LogP1.09
Rot. Bonds3

About ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine

ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine (PubChem CID 169146501) has the molecular formula C9H23N3O and a molecular weight of 189.30 g/mol. Its IUPAC name is ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine.

Molecular Properties

Compound Nameethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine
PubChem CID169146501
Molecular FormulaC9H23N3O
Molecular Weight189.30 g/mol
Exact Mass189.18
IUPAC Nameethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine
SMILESCC.CC(C)(C)OC/C(N)=C/NN
InChIInChI=1S/C7H17N3O.C2H6/c1-7(2,3)11-5-6(8)4-10-9;1-2/h4,10H,5,8-9H2,1-3H3;1-2H3/b6-4-;
InChIKeyDFFUVBTVJDENOE-YHSAGPEESA-N
XLogP1.09
TPSA73.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine 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

3-Ethyl-5-(propan-2-yloxymethyl)-1,2-dihydrotriazole
CID 142397408
(Z)-1-hydrazinyl-3-methoxyprop-1-en-2-amine
CID 144565913
(Z)-1-hydrazinyl-3-propan-2-yloxyprop-1-en-2-amine
CID 156869223
(Z)-1-[amino(butyl)amino]-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine
CID 170272509
(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine
CID 169146502

Frequently Asked Questions

What is the IUPAC name of ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine?
The IUPAC name of ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine (CID 169146501) is ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine.
What is the SMILES notation for ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine?
The canonical SMILES for ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine is CC.CC(C)(C)OC/C(N)=C/NN.
What is the InChIKey of ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine?
The InChIKey is DFFUVBTVJDENOE-YHSAGPEESA-N. The full InChI is InChI=1S/C7H17N3O.C2H6/c1-7(2,3)11-5-6(8)4-10-9;1-2/h4,10H,5,8-9H2,1-3H3;1-2H3/b6-4-;.
What are the key properties of ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine?
ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine has a molecular weight of 189.30 g/mol, XLogP of 1.09, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(Z)-1-hydrazinyl-3-[(2-methylpropan-2-yl)oxy]prop-1-en-2-amine is sourced from PubChem (CID 169146501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).