(2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine

C11H16N2 — CID 138706013

IUPAC(2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine
SMILESC/C=C\C(CC)=C1\C=CC=CN1N
InChIInChI=1S/C11H16N2/c1-3-7-10(4-2)11-8-5-6-9-13(11)12/h3,5-9H,4,12H2,1-2H3/b7-3-,11-10-
InChIKeyDIFYRUATPKCGBD-OERQCDSNSA-N
MW176.26 g/mol
LogP2.49
Rot. Bonds2

About (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine

(2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine (PubChem CID 138706013) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine.

Molecular Properties

Compound Name(2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine
PubChem CID138706013
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name(2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine
SMILESC/C=C\C(CC)=C1\C=CC=CN1N
InChIInChI=1S/C11H16N2/c1-3-7-10(4-2)11-8-5-6-9-13(11)12/h3,5-9H,4,12H2,1-2H3/b7-3-,11-10-
InChIKeyDIFYRUATPKCGBD-OERQCDSNSA-N
XLogP2.49
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine?
The IUPAC name of (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine (CID 138706013) is (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine.
What is the SMILES notation for (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine?
The canonical SMILES for (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine is C/C=C\C(CC)=C1\C=CC=CN1N.
What is the InChIKey of (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine?
The InChIKey is DIFYRUATPKCGBD-OERQCDSNSA-N. The full InChI is InChI=1S/C11H16N2/c1-3-7-10(4-2)11-8-5-6-9-13(11)12/h3,5-9H,4,12H2,1-2H3/b7-3-,11-10-.
What are the key properties of (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine?
(2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine has a molecular weight of 176.26 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(Z)-hex-4-en-3-ylidene]pyridin-1-amine is sourced from PubChem (CID 138706013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).