(E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine

C8H16N2 — CID 134567670

IUPAC(E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine
SMILESC/N=C(C)/C(C)=C(\C)NC
InChIInChI=1S/C8H16N2/c1-6(7(2)9-4)8(3)10-5/h9H,1-5H3/b7-6+,10-8+
InChIKeyFOGFCGTWIGCISK-LQPGMRSMSA-N
MW140.23 g/mol
LogP1.59
Rot. Bonds2

About (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine

(E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine (PubChem CID 134567670) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine.

Molecular Properties

Compound Name(E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine
PubChem CID134567670
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine
SMILESC/N=C(C)/C(C)=C(\C)NC
InChIInChI=1S/C8H16N2/c1-6(7(2)9-4)8(3)10-5/h9H,1-5H3/b7-6+,10-8+
InChIKeyFOGFCGTWIGCISK-LQPGMRSMSA-N
XLogP1.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine?
The IUPAC name of (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine (CID 134567670) is (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine.
What is the SMILES notation for (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine?
The canonical SMILES for (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine is C/N=C(C)/C(C)=C(\C)NC.
What is the InChIKey of (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine?
The InChIKey is FOGFCGTWIGCISK-LQPGMRSMSA-N. The full InChI is InChI=1S/C8H16N2/c1-6(7(2)9-4)8(3)10-5/h9H,1-5H3/b7-6+,10-8+.
What are the key properties of (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine?
(E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine has a molecular weight of 140.23 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,3-dimethyl-4-methyliminopent-2-en-2-amine is sourced from PubChem (CID 134567670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).