(E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine

C10H17N — CID 135188940

IUPAC(E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine
SMILESC/C=C\N=C\C=C\C(C)(C)C
InChIInChI=1S/C10H17N/c1-5-8-11-9-6-7-10(2,3)4/h5-9H,1-4H3/b7-6+,8-5-,11-9+
InChIKeyVDTNQGAYAHLJFM-FEGYGTLZSA-N
MW151.25 g/mol
LogP3.19
Rot. Bonds2

About (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine

(E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine (PubChem CID 135188940) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine.

Molecular Properties

Compound Name(E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine
PubChem CID135188940
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine
SMILESC/C=C\N=C\C=C\C(C)(C)C
InChIInChI=1S/C10H17N/c1-5-8-11-9-6-7-10(2,3)4/h5-9H,1-4H3/b7-6+,8-5-,11-9+
InChIKeyVDTNQGAYAHLJFM-FEGYGTLZSA-N
XLogP3.19
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine?
The IUPAC name of (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine (CID 135188940) is (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine.
What is the SMILES notation for (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine?
The canonical SMILES for (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine is C/C=C\N=C\C=C\C(C)(C)C.
What is the InChIKey of (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine?
The InChIKey is VDTNQGAYAHLJFM-FEGYGTLZSA-N. The full InChI is InChI=1S/C10H17N/c1-5-8-11-9-6-7-10(2,3)4/h5-9H,1-4H3/b7-6+,8-5-,11-9+.
What are the key properties of (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine?
(E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine has a molecular weight of 151.25 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4,4-dimethyl-N-[(Z)-prop-1-enyl]pent-2-en-1-imine is sourced from PubChem (CID 135188940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).