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

C14H18N2 — CID 155109542

IUPAC(2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine
SMILESC=C/C=c1/c(NC(C)C)ccn/c1=C/C=C
InChIInChI=1S/C14H18N2/c1-5-7-12-13(8-6-2)15-10-9-14(12)16-11(3)4/h5-11,16H,1-2H2,3-4H3/b12-7+,13-8+
InChIKeyHUWZOLCMWRWUKQ-INOXDZRUSA-N
MW214.31 g/mol
LogP1.83
Rot. Bonds4

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

(2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine (PubChem CID 155109542) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine.

Molecular Properties

Compound Name(2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine
PubChem CID155109542
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name(2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine
SMILESC=C/C=c1/c(NC(C)C)ccn/c1=C/C=C
InChIInChI=1S/C14H18N2/c1-5-7-12-13(8-6-2)15-10-9-14(12)16-11(3)4/h5-11,16H,1-2H2,3-4H3/b12-7+,13-8+
InChIKeyHUWZOLCMWRWUKQ-INOXDZRUSA-N
XLogP1.83
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine?
The IUPAC name of (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine (CID 155109542) is (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine.
What is the SMILES notation for (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine?
The canonical SMILES for (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine is C=C/C=c1/c(NC(C)C)ccn/c1=C/C=C.
What is the InChIKey of (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine?
The InChIKey is HUWZOLCMWRWUKQ-INOXDZRUSA-N. The full InChI is InChI=1S/C14H18N2/c1-5-7-12-13(8-6-2)15-10-9-14(12)16-11(3)4/h5-11,16H,1-2H2,3-4H3/b12-7+,13-8+.
What are the key properties of (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine?
(2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine has a molecular weight of 214.31 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-N-propan-2-yl-2,3-bis(prop-2-enylidene)pyridin-4-amine is sourced from PubChem (CID 155109542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).