(E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine

C11H13N3 — CID 170055922

IUPAC(E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine
SMILESCC/C=c1\c(=C/N)nc2ccccn12
InChIInChI=1S/C11H13N3/c1-2-5-10-9(8-12)13-11-6-3-4-7-14(10)11/h3-8H,2,12H2,1H3/b9-8+,10-5+
InChIKeyDVKUBCVFYDMFCT-VZGHUFTCSA-N
MW187.25 g/mol
LogP0.22
Rot. Bonds1

About (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine

(E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine (PubChem CID 170055922) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine.

Molecular Properties

Compound Name(E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine
PubChem CID170055922
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name(E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine
SMILESCC/C=c1\c(=C/N)nc2ccccn12
InChIInChI=1S/C11H13N3/c1-2-5-10-9(8-12)13-11-6-3-4-7-14(10)11/h3-8H,2,12H2,1H3/b9-8+,10-5+
InChIKeyDVKUBCVFYDMFCT-VZGHUFTCSA-N
XLogP0.22
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine?
The IUPAC name of (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine (CID 170055922) is (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine.
What is the SMILES notation for (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine?
The canonical SMILES for (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine is CC/C=c1\c(=C/N)nc2ccccn12.
What is the InChIKey of (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine?
The InChIKey is DVKUBCVFYDMFCT-VZGHUFTCSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-5-10-9(8-12)13-11-6-3-4-7-14(10)11/h3-8H,2,12H2,1H3/b9-8+,10-5+.
What are the key properties of (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine?
(E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine has a molecular weight of 187.25 g/mol, XLogP of 0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-[(3E)-3-propylideneimidazo[1,2-a]pyridin-2-ylidene]methanamine is sourced from PubChem (CID 170055922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).