(Z)-2-(3-chloro-2-pyridinyl)ethenamine

C7H7ClN2 — CID 176928327

IUPAC(Z)-2-(3-chloro-2-pyridinyl)ethenamine
SMILESN/C=C\c1ncccc1Cl
InChIInChI=1S/C7H7ClN2/c8-6-2-1-5-10-7(6)3-4-9/h1-5H,9H2/b4-3-
InChIKeyKGIFNPFQESOQJO-ARJAWSKDSA-N
MW154.60 g/mol
LogP1.66
Rot. Bonds1

About (Z)-2-(3-chloro-2-pyridinyl)ethenamine

(Z)-2-(3-chloro-2-pyridinyl)ethenamine (PubChem CID 176928327) has the molecular formula C7H7ClN2 and a molecular weight of 154.60 g/mol. Its IUPAC name is (Z)-2-(3-chloro-2-pyridinyl)ethenamine.

Molecular Properties

Compound Name(Z)-2-(3-chloro-2-pyridinyl)ethenamine
PubChem CID176928327
Molecular FormulaC7H7ClN2
Molecular Weight154.60 g/mol
Exact Mass154.03
IUPAC Name(Z)-2-(3-chloro-2-pyridinyl)ethenamine
SMILESN/C=C\c1ncccc1Cl
InChIInChI=1S/C7H7ClN2/c8-6-2-1-5-10-7(6)3-4-9/h1-5H,9H2/b4-3-
InChIKeyKGIFNPFQESOQJO-ARJAWSKDSA-N
XLogP1.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-(3-chloro-2-pyridinyl)ethenamine?
The IUPAC name of (Z)-2-(3-chloro-2-pyridinyl)ethenamine (CID 176928327) is (Z)-2-(3-chloro-2-pyridinyl)ethenamine.
What is the SMILES notation for (Z)-2-(3-chloro-2-pyridinyl)ethenamine?
The canonical SMILES for (Z)-2-(3-chloro-2-pyridinyl)ethenamine is N/C=C\c1ncccc1Cl.
What is the InChIKey of (Z)-2-(3-chloro-2-pyridinyl)ethenamine?
The InChIKey is KGIFNPFQESOQJO-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H7ClN2/c8-6-2-1-5-10-7(6)3-4-9/h1-5H,9H2/b4-3-.
What are the key properties of (Z)-2-(3-chloro-2-pyridinyl)ethenamine?
(Z)-2-(3-chloro-2-pyridinyl)ethenamine has a molecular weight of 154.60 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(3-chloro-2-pyridinyl)ethenamine is sourced from PubChem (CID 176928327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).