ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine

C8H18N2 — CID 145193146

IUPACethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine
SMILESCC.CC(C)=N/C=C(/C)N
InChIInChI=1S/C6H12N2.C2H6/c1-5(2)8-4-6(3)7;1-2/h4H,7H2,1-3H3;1-2H3/b6-4-;
InChIKeyHPUSMEVNJUKRFX-YHSAGPEESA-N
MW142.25 g/mol
LogP2.31
Rot. Bonds1

About ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine

ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine (PubChem CID 145193146) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine.

Molecular Properties

Compound Nameethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine
PubChem CID145193146
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Nameethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine
SMILESCC.CC(C)=N/C=C(/C)N
InChIInChI=1S/C6H12N2.C2H6/c1-5(2)8-4-6(3)7;1-2/h4H,7H2,1-3H3;1-2H3/b6-4-;
InChIKeyHPUSMEVNJUKRFX-YHSAGPEESA-N
XLogP2.31
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[(Z)-2-aminoprop-1-enyl]iminobut-1-en-2-amine
CID 88216553
(Z)-2-(butan-2-ylideneamino)prop-1-en-1-amine
CID 88874563
(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine
CID 88972436
(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
CID 89138569
N-[(Z)-2-(propan-2-ylideneamino)ethenyl]prop-1-en-2-amine
CID 89152929
(Z)-2-(propan-2-ylideneamino)prop-1-en-1-amine
CID 90079771
(Z)-2-(butan-2-ylideneamino)-N-methylprop-1-en-1-amine
CID 117957547
N'-[(E)-2-(butan-2-ylideneamino)prop-1-enyl]ethanimidamide
CID 123348821
(Z)-1-(butan-2-ylideneamino)-3-methylbut-1-en-2-amine
CID 126724082
N'-[(Z)-2-(propan-2-ylideneamino)prop-1-enyl]ethanimidamide
CID 134408487
(Z)-1-(2-methylpentan-3-ylideneamino)prop-1-en-2-amine
CID 138719703
(Z)-1-(ethylideneamino)prop-1-en-2-amine
CID 141770459

Frequently Asked Questions

What is the IUPAC name of ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine?
The IUPAC name of ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine (CID 145193146) is ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine.
What is the SMILES notation for ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine?
The canonical SMILES for ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine is CC.CC(C)=N/C=C(/C)N.
What is the InChIKey of ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine?
The InChIKey is HPUSMEVNJUKRFX-YHSAGPEESA-N. The full InChI is InChI=1S/C6H12N2.C2H6/c1-5(2)8-4-6(3)7;1-2/h4H,7H2,1-3H3;1-2H3/b6-4-;.
What are the key properties of ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine?
ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine has a molecular weight of 142.25 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(Z)-1-(propan-2-ylideneamino)prop-1-en-2-amine is sourced from PubChem (CID 145193146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).