(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine

C11H12N2 — CID 146427123

IUPAC(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine
SMILESC=C/C=c1/c(N)ccn/c1=C/C=C
InChIInChI=1S/C11H12N2/c1-3-5-9-10(12)7-8-13-11(9)6-4-2/h3-8H,1-2,12H2/b9-5-,11-6+
InChIKeyDMPIMROQJNZYJS-YCQMDOFOSA-N
MW172.23 g/mol
LogP0.60
Rot. Bonds2

About (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine

(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine (PubChem CID 146427123) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine.

Molecular Properties

Compound Name(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine
PubChem CID146427123
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine
SMILESC=C/C=c1/c(N)ccn/c1=C/C=C
InChIInChI=1S/C11H12N2/c1-3-5-9-10(12)7-8-13-11(9)6-4-2/h3-8H,1-2,12H2/b9-5-,11-6+
InChIKeyDMPIMROQJNZYJS-YCQMDOFOSA-N
XLogP0.60
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine?
The IUPAC name of (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine (CID 146427123) is (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine.
What is the SMILES notation for (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine?
The canonical SMILES for (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine is C=C/C=c1/c(N)ccn/c1=C/C=C.
What is the InChIKey of (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine?
The InChIKey is DMPIMROQJNZYJS-YCQMDOFOSA-N. The full InChI is InChI=1S/C11H12N2/c1-3-5-9-10(12)7-8-13-11(9)6-4-2/h3-8H,1-2,12H2/b9-5-,11-6+.
What are the key properties of (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine?
(2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine has a molecular weight of 172.23 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-2,3-bis(prop-2-enylidene)pyridin-4-amine is sourced from PubChem (CID 146427123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).