N-[(E)-but-1-enyl]pyridin-2-amine

C9H12N2 — CID 69443229

IUPACN-[(E)-but-1-enyl]pyridin-2-amine
SMILESCC/C=C/Nc1ccccn1
InChIInChI=1S/C9H12N2/c1-2-3-7-10-9-6-4-5-8-11-9/h3-8H,2H2,1H3,(H,10,11)/b7-3+
InChIKeyLVUAQXTUITZAPQ-XVNBXDOJSA-N
MW148.21 g/mol
LogP2.42
Rot. Bonds3

About N-[(E)-but-1-enyl]pyridin-2-amine

N-[(E)-but-1-enyl]pyridin-2-amine (PubChem CID 69443229) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is N-[(E)-but-1-enyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(E)-but-1-enyl]pyridin-2-amine
PubChem CID69443229
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC NameN-[(E)-but-1-enyl]pyridin-2-amine
SMILESCC/C=C/Nc1ccccn1
InChIInChI=1S/C9H12N2/c1-2-3-7-10-9-6-4-5-8-11-9/h3-8H,2H2,1H3,(H,10,11)/b7-3+
InChIKeyLVUAQXTUITZAPQ-XVNBXDOJSA-N
XLogP2.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-but-1-enyl]pyridin-2-amine?
The IUPAC name of N-[(E)-but-1-enyl]pyridin-2-amine (CID 69443229) is N-[(E)-but-1-enyl]pyridin-2-amine.
What is the SMILES notation for N-[(E)-but-1-enyl]pyridin-2-amine?
The canonical SMILES for N-[(E)-but-1-enyl]pyridin-2-amine is CC/C=C/Nc1ccccn1.
What is the InChIKey of N-[(E)-but-1-enyl]pyridin-2-amine?
The InChIKey is LVUAQXTUITZAPQ-XVNBXDOJSA-N. The full InChI is InChI=1S/C9H12N2/c1-2-3-7-10-9-6-4-5-8-11-9/h3-8H,2H2,1H3,(H,10,11)/b7-3+.
What are the key properties of N-[(E)-but-1-enyl]pyridin-2-amine?
N-[(E)-but-1-enyl]pyridin-2-amine has a molecular weight of 148.21 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-but-1-enyl]pyridin-2-amine is sourced from PubChem (CID 69443229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).