(6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol

C12H20N2O — CID 166973844

IUPAC(6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol
SMILESCCCN1C=C(O)C(C(C)C)=C/C1=C/N
InChIInChI=1S/C12H20N2O/c1-4-5-14-8-12(15)11(9(2)3)6-10(14)7-13/h6-9,15H,4-5,13H2,1-3H3/b10-7-
InChIKeyMOPUAELYIAUUTE-YFHOEESVSA-N
MW208.30 g/mol
LogP2.49
Rot. Bonds3

About (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol

(6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol (PubChem CID 166973844) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol.

Molecular Properties

Compound Name(6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol
PubChem CID166973844
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name(6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol
SMILESCCCN1C=C(O)C(C(C)C)=C/C1=C/N
InChIInChI=1S/C12H20N2O/c1-4-5-14-8-12(15)11(9(2)3)6-10(14)7-13/h6-9,15H,4-5,13H2,1-3H3/b10-7-
InChIKeyMOPUAELYIAUUTE-YFHOEESVSA-N
XLogP2.49
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol?
The IUPAC name of (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol (CID 166973844) is (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol.
What is the SMILES notation for (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol?
The canonical SMILES for (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol is CCCN1C=C(O)C(C(C)C)=C/C1=C/N.
What is the InChIKey of (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol?
The InChIKey is MOPUAELYIAUUTE-YFHOEESVSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-5-14-8-12(15)11(9(2)3)6-10(14)7-13/h6-9,15H,4-5,13H2,1-3H3/b10-7-.
What are the key properties of (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol?
(6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol has a molecular weight of 208.30 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-(aminomethylidene)-4-propan-2-yl-1-propylpyridin-3-ol is sourced from PubChem (CID 166973844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).