[6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol

C12H16N4O — CID 114273085

IUPAC[6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol
SMILESCN(C)c1ccc(C(O)c2cnn(C)c2)cn1
InChIInChI=1S/C12H16N4O/c1-15(2)11-5-4-9(6-13-11)12(17)10-7-14-16(3)8-10/h4-8,12,17H,1-3H3
InChIKeyZYJYRLVNEUCEQP-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.96
Rot. Bonds3

About [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol

[6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol (PubChem CID 114273085) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name[6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol
PubChem CID114273085
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name[6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol
SMILESCN(C)c1ccc(C(O)c2cnn(C)c2)cn1
InChIInChI=1S/C12H16N4O/c1-15(2)11-5-4-9(6-13-11)12(17)10-7-14-16(3)8-10/h4-8,12,17H,1-3H3
InChIKeyZYJYRLVNEUCEQP-UHFFFAOYSA-N
XLogP0.96
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(6-methoxy-3-pyridinyl)-(1-methylpyrazol-4-yl)methanol
CID 114937913
(4-chlorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 61088026
(3-chloro-4-iodophenyl)-(1-methylpyrazol-4-yl)methanol
CID 103216660
3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(1-methylpyrazol-4-yl)methanol
CID 63894860
(3,4-diethoxyphenyl)-(1-methylpyrazol-4-yl)methanol
CID 61088204
(4-chloro-3-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 63895357
(1-methylpyrazol-4-yl)-(5-methyl-3-pyridinyl)methanol
CID 115373634
(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 61088379
3-[hydroxy-(1-methylpyrazol-4-yl)methyl]benzonitrile
CID 115481066
N,N-dimethyl-5-[1-(methylamino)ethyl]pyridin-2-amine
CID 115563160
(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol
CID 66116496
(3,5-dichloro-2-pyridinyl)-(1-methylpyrazol-4-yl)methanol
CID 79780527

Frequently Asked Questions

What is the IUPAC name of [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol?
The IUPAC name of [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol (CID 114273085) is [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol.
What is the SMILES notation for [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol?
The canonical SMILES for [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol is CN(C)c1ccc(C(O)c2cnn(C)c2)cn1.
What is the InChIKey of [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol?
The InChIKey is ZYJYRLVNEUCEQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-15(2)11-5-4-9(6-13-11)12(17)10-7-14-16(3)8-10/h4-8,12,17H,1-3H3.
What are the key properties of [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol?
[6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol has a molecular weight of 232.29 g/mol, XLogP of 0.96, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(dimethylamino)-3-pyridinyl]-(1-methylpyrazol-4-yl)methanol is sourced from PubChem (CID 114273085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).