N'-propan-2-yl-N-propan-2-ylideneethanimidamide

C8H16N2 — CID 143703583

IUPACN'-propan-2-yl-N-propan-2-ylideneethanimidamide
SMILESCC(C)=N/C(C)=N/C(C)C
InChIInChI=1S/C8H16N2/c1-6(2)9-8(5)10-7(3)4/h6H,1-5H3/b9-8+
InChIKeyIRKHXXALDNUVIC-CMDGGOBGSA-N
MW140.23 g/mol
LogP2.29
Rot. Bonds1

About N'-propan-2-yl-N-propan-2-ylideneethanimidamide

N'-propan-2-yl-N-propan-2-ylideneethanimidamide (PubChem CID 143703583) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N'-propan-2-yl-N-propan-2-ylideneethanimidamide.

Molecular Properties

Compound NameN'-propan-2-yl-N-propan-2-ylideneethanimidamide
PubChem CID143703583
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN'-propan-2-yl-N-propan-2-ylideneethanimidamide
SMILESCC(C)=N/C(C)=N/C(C)C
InChIInChI=1S/C8H16N2/c1-6(2)9-8(5)10-7(3)4/h6H,1-5H3/b9-8+
InChIKeyIRKHXXALDNUVIC-CMDGGOBGSA-N
XLogP2.29
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-methyl-N-propan-2-ylideneethanimidamide
CID 158478143
ethane;N'-methyl-N-propan-2-ylideneethanimidamide
CID 142000403
(3R)-3-chloro-N-propan-2-ylbutan-2-imine
CID 102396350
N-propan-2-ylbutan-2-imine
CID 535666
N',2-dimethyl-N-propan-2-ylidenepropanimidamide
CID 167026790
1,1,1-trifluoro-N-propan-2-ylpropan-2-imine
CID 2759496
N,N'-di(propan-2-yl)ethanimidamide
CID 11205611
N'-cyclopropyl-N-propan-2-ylideneethanimidamide
CID 167096909
tris(N,N'-di(propan-2-yl)ethanimidamide);ruthenium
CID 158470992
3-chloro-3-methyl-N-propan-2-ylbutan-2-imine
CID 12696210
cobalt(2+);bis(N,N'-di(propan-2-yl)ethanimidamide)
CID 172756363
1-hydrazinylidene-N-propan-2-ylpropan-2-imine
CID 174073381

Frequently Asked Questions

What is the IUPAC name of N'-propan-2-yl-N-propan-2-ylideneethanimidamide?
The IUPAC name of N'-propan-2-yl-N-propan-2-ylideneethanimidamide (CID 143703583) is N'-propan-2-yl-N-propan-2-ylideneethanimidamide.
What is the SMILES notation for N'-propan-2-yl-N-propan-2-ylideneethanimidamide?
The canonical SMILES for N'-propan-2-yl-N-propan-2-ylideneethanimidamide is CC(C)=N/C(C)=N/C(C)C.
What is the InChIKey of N'-propan-2-yl-N-propan-2-ylideneethanimidamide?
The InChIKey is IRKHXXALDNUVIC-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H16N2/c1-6(2)9-8(5)10-7(3)4/h6H,1-5H3/b9-8+.
What are the key properties of N'-propan-2-yl-N-propan-2-ylideneethanimidamide?
N'-propan-2-yl-N-propan-2-ylideneethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 2.29, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propan-2-yl-N-propan-2-ylideneethanimidamide is sourced from PubChem (CID 143703583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).