N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide

C8H16N2 — CID 137482643

IUPACN-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide
SMILESC/C=C\N=C(/C)N(C)CC
InChIInChI=1S/C8H16N2/c1-5-7-9-8(3)10(4)6-2/h5,7H,6H2,1-4H3/b7-5-,9-8+
InChIKeyAAIKTNBCMKZIHJ-SUHGFZJFSA-N
MW140.23 g/mol
LogP1.89
Rot. Bonds2

About N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide

N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide (PubChem CID 137482643) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide
PubChem CID137482643
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide
SMILESC/C=C\N=C(/C)N(C)CC
InChIInChI=1S/C8H16N2/c1-5-7-9-8(3)10(4)6-2/h5,7H,6H2,1-4H3/b7-5-,9-8+
InChIKeyAAIKTNBCMKZIHJ-SUHGFZJFSA-N
XLogP1.89
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.89
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-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide?
The IUPAC name of N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide (CID 137482643) is N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide.
What is the SMILES notation for N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide?
The canonical SMILES for N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide is C/C=C\N=C(/C)N(C)CC.
What is the InChIKey of N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide?
The InChIKey is AAIKTNBCMKZIHJ-SUHGFZJFSA-N. The full InChI is InChI=1S/C8H16N2/c1-5-7-9-8(3)10(4)6-2/h5,7H,6H2,1-4H3/b7-5-,9-8+.
What are the key properties of N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide?
N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-N'-[(Z)-prop-1-enyl]ethanimidamide is sourced from PubChem (CID 137482643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).