(2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine

C10H14N2 — CID 139397660

IUPAC(2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine
SMILESC=C/C(C)=C1/C=CC=C(C)N1N
InChIInChI=1S/C10H14N2/c1-4-8(2)10-7-5-6-9(3)12(10)11/h4-7H,1,11H2,2-3H3/b10-8-
InChIKeyIPYBQQUFGQJAGR-NTMALXAHSA-N
MW162.24 g/mol
LogP2.10
Rot. Bonds1

About (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine

(2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine (PubChem CID 139397660) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine.

Molecular Properties

Compound Name(2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine
PubChem CID139397660
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name(2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine
SMILESC=C/C(C)=C1/C=CC=C(C)N1N
InChIInChI=1S/C10H14N2/c1-4-8(2)10-7-5-6-9(3)12(10)11/h4-7H,1,11H2,2-3H3/b10-8-
InChIKeyIPYBQQUFGQJAGR-NTMALXAHSA-N
XLogP2.10
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.10
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-but-3-en-2-ylidene-6-methylpyridin-1-amine?
The IUPAC name of (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine (CID 139397660) is (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine.
What is the SMILES notation for (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine?
The canonical SMILES for (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine is C=C/C(C)=C1/C=CC=C(C)N1N.
What is the InChIKey of (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine?
The InChIKey is IPYBQQUFGQJAGR-NTMALXAHSA-N. The full InChI is InChI=1S/C10H14N2/c1-4-8(2)10-7-5-6-9(3)12(10)11/h4-7H,1,11H2,2-3H3/b10-8-.
What are the key properties of (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine?
(2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine has a molecular weight of 162.24 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-but-3-en-2-ylidene-6-methylpyridin-1-amine is sourced from PubChem (CID 139397660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).