N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine

C6H10N2 — CID 90089206

IUPACN-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine
SMILESC=N/C(C)=C\N=C\C
InChIInChI=1S/C6H10N2/c1-4-8-5-6(2)7-3/h4-5H,3H2,1-2H3/b6-5-,8-4+
InChIKeyNKJHGZSMFLMLLM-QNMAEOQASA-N
MW110.16 g/mol
LogP1.64
Rot. Bonds2

About N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine

N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine (PubChem CID 90089206) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine.

Molecular Properties

Compound NameN-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine
PubChem CID90089206
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC NameN-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine
SMILESC=N/C(C)=C\N=C\C
InChIInChI=1S/C6H10N2/c1-4-8-5-6(2)7-3/h4-5H,3H2,1-2H3/b6-5-,8-4+
InChIKeyNKJHGZSMFLMLLM-QNMAEOQASA-N
XLogP1.64
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.64
H-Bond Donors ≤ 50
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 N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine?
The IUPAC name of N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine (CID 90089206) is N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine.
What is the SMILES notation for N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine?
The canonical SMILES for N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine is C=N/C(C)=C\N=C\C.
What is the InChIKey of N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine?
The InChIKey is NKJHGZSMFLMLLM-QNMAEOQASA-N. The full InChI is InChI=1S/C6H10N2/c1-4-8-5-6(2)7-3/h4-5H,3H2,1-2H3/b6-5-,8-4+.
What are the key properties of N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine?
N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine has a molecular weight of 110.16 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimine is sourced from PubChem (CID 90089206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).