(1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol

C11H13NO — CID 143770388

IUPAC(1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol
SMILESC=C/C(O)=c1/nc(C)cc/c1=C/C
InChIInChI=1S/C11H13NO/c1-4-9-7-6-8(3)12-11(9)10(13)5-2/h4-7,13H,2H2,1,3H3/b9-4-,11-10-
InChIKeySPGZBDRCRXOVRC-ISIMONSRSA-N
MW175.23 g/mol
LogP1.04
Rot. Bonds1

About (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol

(1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol (PubChem CID 143770388) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol.

Molecular Properties

Compound Name(1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol
PubChem CID143770388
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name(1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol
SMILESC=C/C(O)=c1/nc(C)cc/c1=C/C
InChIInChI=1S/C11H13NO/c1-4-9-7-6-8(3)12-11(9)10(13)5-2/h4-7,13H,2H2,1,3H3/b9-4-,11-10-
InChIKeySPGZBDRCRXOVRC-ISIMONSRSA-N
XLogP1.04
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol?
The IUPAC name of (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol (CID 143770388) is (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol.
What is the SMILES notation for (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol?
The canonical SMILES for (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol is C=C/C(O)=c1/nc(C)cc/c1=C/C.
What is the InChIKey of (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol?
The InChIKey is SPGZBDRCRXOVRC-ISIMONSRSA-N. The full InChI is InChI=1S/C11H13NO/c1-4-9-7-6-8(3)12-11(9)10(13)5-2/h4-7,13H,2H2,1,3H3/b9-4-,11-10-.
What are the key properties of (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol?
(1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol has a molecular weight of 175.23 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1-[(3Z)-3-ethylidene-6-methyl-2-pyridinylidene]prop-2-en-1-ol is sourced from PubChem (CID 143770388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).