(2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine

C14H23N — CID 89327958

IUPAC(2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine
SMILESC/C=C\C(C/C=C/C)C(C)/C=C\C=N\C
InChIInChI=1S/C14H23N/c1-5-7-11-14(9-6-2)13(3)10-8-12-15-4/h5-10,12-14H,11H2,1-4H3/b7-5+,9-6-,10-8-,15-12+
InChIKeyJVINTAPXQRUWOG-DQTKTAHDSA-N
MW205.34 g/mol
LogP4.04
Rot. Bonds6

About (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine

(2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine (PubChem CID 89327958) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine.

Molecular Properties

Compound Name(2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine
PubChem CID89327958
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name(2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine
SMILESC/C=C\C(C/C=C/C)C(C)/C=C\C=N\C
InChIInChI=1S/C14H23N/c1-5-7-11-14(9-6-2)13(3)10-8-12-15-4/h5-10,12-14H,11H2,1-4H3/b7-5+,9-6-,10-8-,15-12+
InChIKeyJVINTAPXQRUWOG-DQTKTAHDSA-N
XLogP4.04
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine?
The IUPAC name of (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine (CID 89327958) is (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine.
What is the SMILES notation for (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine?
The canonical SMILES for (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine is C/C=C\C(C/C=C/C)C(C)/C=C\C=N\C.
What is the InChIKey of (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine?
The InChIKey is JVINTAPXQRUWOG-DQTKTAHDSA-N. The full InChI is InChI=1S/C14H23N/c1-5-7-11-14(9-6-2)13(3)10-8-12-15-4/h5-10,12-14H,11H2,1-4H3/b7-5+,9-6-,10-8-,15-12+.
What are the key properties of (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine?
(2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine has a molecular weight of 205.34 g/mol, XLogP of 4.04, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,7E)-N,4-dimethyl-5-[(Z)-prop-1-enyl]nona-2,7-dien-1-imine is sourced from PubChem (CID 89327958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).