N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane

C8H18N2 — CID 143399720

IUPACN,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane
SMILESC/C=C\N(C)/C=N/C.CC
InChIInChI=1S/C6H12N2.C2H6/c1-4-5-8(3)6-7-2;1-2/h4-6H,1-3H3;1-2H3/b5-4-,7-6+;
InChIKeyQZVOHSSJKQTURU-YLKXMWBMSA-N
MW142.25 g/mol
LogP2.14
Rot. Bonds2

About N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane

N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane (PubChem CID 143399720) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane.

Molecular Properties

Compound NameN,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane
PubChem CID143399720
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane
SMILESC/C=C\N(C)/C=N/C.CC
InChIInChI=1S/C6H12N2.C2H6/c1-4-5-8(3)6-7-2;1-2/h4-6H,1-3H3;1-2H3/b5-4-,7-6+;
InChIKeyQZVOHSSJKQTURU-YLKXMWBMSA-N
XLogP2.14
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 52.14
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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Frequently Asked Questions

What is the IUPAC name of N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane?
The IUPAC name of N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane (CID 143399720) is N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane.
What is the SMILES notation for N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane?
The canonical SMILES for N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane is C/C=C\N(C)/C=N/C.CC.
What is the InChIKey of N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane?
The InChIKey is QZVOHSSJKQTURU-YLKXMWBMSA-N. The full InChI is InChI=1S/C6H12N2.C2H6/c1-4-5-8(3)6-7-2;1-2/h4-6H,1-3H3;1-2H3/b5-4-,7-6+;.
What are the key properties of N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane?
N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane has a molecular weight of 142.25 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-N-[(Z)-prop-1-enyl]methanimidamide;ethane is sourced from PubChem (CID 143399720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).