N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide

C8H16N2 — CID 163950051

IUPACN-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide
SMILESCC/C=C\N(C)/C=N/CC
InChIInChI=1S/C8H16N2/c1-4-6-7-10(3)8-9-5-2/h6-8H,4-5H2,1-3H3/b7-6-,9-8+
InChIKeyRYNJQRPREICPDJ-NMMTYZSQSA-N
MW140.23 g/mol
LogP1.89
Rot. Bonds4

About N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide

N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide (PubChem CID 163950051) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide.

Molecular Properties

Compound NameN-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide
PubChem CID163950051
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide
SMILESCC/C=C\N(C)/C=N/CC
InChIInChI=1S/C8H16N2/c1-4-6-7-10(3)8-9-5-2/h6-8H,4-5H2,1-3H3/b7-6-,9-8+
InChIKeyRYNJQRPREICPDJ-NMMTYZSQSA-N
XLogP1.89
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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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Related Compounds

(E)-N-[(E)-but-1-enyl]-N-methylbut-1-en-1-amine
CID 23150812
N,N'-diethyl-N-methylmethanimidamide
CID 88937103
(Z)-N-methyl-N-[(methylideneamino)methyl]but-1-en-1-amine
CID 134365422
(Z)-hex-3-ene;methylazanium
CID 158917607
N'-ethyl-N,N-dipropylmethanimidamide;hydrochloride
CID 88610819
(E)-N-methyl-N-(2-methylpropyl)but-1-en-1-amine
CID 174085741
N,N-dipropylbut-1-en-1-amine
CID 575133
2-ethylimino-N,N-dimethylethanamine
CID 88957050
N,N-bis(trimethylsilyl)but-1-en-1-amine
CID 73177613
N-[(Z)-but-1-enyl]-N-methylpropanamide
CID 142943923
buta-1,3-diene;ethane;N-ethylpropan-1-imine
CID 143326323
N-but-1-enyl-N-ethylpent-2-en-3-amine
CID 123927665

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide?
The IUPAC name of N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide (CID 163950051) is N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide.
What is the SMILES notation for N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide?
The canonical SMILES for N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide is CC/C=C\N(C)/C=N/CC.
What is the InChIKey of N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide?
The InChIKey is RYNJQRPREICPDJ-NMMTYZSQSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-6-7-10(3)8-9-5-2/h6-8H,4-5H2,1-3H3/b7-6-,9-8+.
What are the key properties of N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide?
N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.89, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-but-1-enyl]-N'-ethyl-N-methylmethanimidamide is sourced from PubChem (CID 163950051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).