(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine

C8H16N2 — CID 142329757

IUPAC(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine
SMILESC/N=C/C(=C\NC)C(C)C
InChIInChI=1S/C8H16N2/c1-7(2)8(5-9-3)6-10-4/h5-7,9H,1-4H3/b8-5+,10-6+
InChIKeyGSLHZFDURSDRCQ-YLDLMLGBSA-N
MW140.23 g/mol
LogP1.45
Rot. Bonds3

About (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine

(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine (PubChem CID 142329757) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine
PubChem CID142329757
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine
SMILESC/N=C/C(=C\NC)C(C)C
InChIInChI=1S/C8H16N2/c1-7(2)8(5-9-3)6-10-4/h5-7,9H,1-4H3/b8-5+,10-6+
InChIKeyGSLHZFDURSDRCQ-YLDLMLGBSA-N
XLogP1.45
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.45
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

N-ethenyl-3-methyl-2-(methyliminomethyl)but-1-en-1-amine
CID 174103699
ethane;ethene;(Z)-N-methyl-2-propan-2-ylbut-2-en-1-imine
CID 169242531
N-methyl-3-(methyliminomethyl)hex-3-en-2-amine
CID 123203381
(E)-3-(methylamino)-2-(methyliminomethyl)prop-2-enal
CID 145012913
(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine
CID 163527626
(Z)-4-methyl-3-[(Z)-(methylhydrazinylidene)methyl]pent-2-enal
CID 155054347
N,N'-dimethyl-2-methyliminoethanimidamide
CID 90453900
N,3-dimethyl-1-methyliminobut-2-en-2-amine
CID 142871224
2-N-methyl-3-methyliminoprop-1-ene-1,2-diamine
CID 146703822
(2Z,4Z)-5-(methylamino)-3-propan-2-ylpenta-2,4-dienal
CID 169269708
(2Z,4Z)-5-(methylamino)-2-propan-2-ylpenta-2,4-dienal
CID 131980383
(3E,5R,6R)-6-(methylamino)-4-(methyliminomethyl)nona-1,3-dien-5-ol
CID 167118087

Frequently Asked Questions

What is the IUPAC name of (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine?
The IUPAC name of (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine (CID 142329757) is (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine.
What is the SMILES notation for (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine?
The canonical SMILES for (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine is C/N=C/C(=C\NC)C(C)C.
What is the InChIKey of (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine?
The InChIKey is GSLHZFDURSDRCQ-YLDLMLGBSA-N. The full InChI is InChI=1S/C8H16N2/c1-7(2)8(5-9-3)6-10-4/h5-7,9H,1-4H3/b8-5+,10-6+.
What are the key properties of (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine?
(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine is sourced from PubChem (CID 142329757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).