3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol

C14H20N4O2 — CID 75430363

IUPAC3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol
SMILESCc1cnn(-c2cccc(N(CCO)CCCO)n2)c1
InChIInChI=1S/C14H20N4O2/c1-12-10-15-18(11-12)14-5-2-4-13(16-14)17(7-9-20)6-3-8-19/h2,4-5,10-11,19-20H,3,6-9H2,1H3
InChIKeyMQMGFJJQLLILCN-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.76
Rot. Bonds7

About 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol

3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol (PubChem CID 75430363) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol.

Molecular Properties

Compound Name3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol
PubChem CID75430363
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol
SMILESCc1cnn(-c2cccc(N(CCO)CCCO)n2)c1
InChIInChI=1S/C14H20N4O2/c1-12-10-15-18(11-12)14-5-2-4-13(16-14)17(7-9-20)6-3-8-19/h2,4-5,10-11,19-20H,3,6-9H2,1H3
InChIKeyMQMGFJJQLLILCN-UHFFFAOYSA-N
XLogP0.76
TPSA74.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1H-pyrazol-1-yl)pyridine
CID 5324086
2-(3-pyridin-4-yl-4H-1,2,4-triazol-4-yl)butan-1-ol
CID 3235743
(3R)-1-[[1-(2-anilinopyrimidin-4-yl)-3-methylpyrazol-4-yl]methyl]pyrrolidin-3-ol
CID 122192139
(6-(1H-pyrazol-1-yl)pyridin-3-yl)methanol
CID 15980534
(6-(1H-pyrazol-1-yl)pyridin-3-yl)methanamine
CID 16227471
(2-(1H-pyrazol-1-yl)pyridin-4-yl)methanamine
CID 16781103
1-[2-(1H-pyrazol-1-yl)pyridin-3-yl]methanamine
CID 16792973
(2-(1H-Pyrazol-1-YL)pyridin-4-YL)methanol
CID 61256684
1-(4-methylpyridin-2-yl)-1H-pyrazol-5-amine
CID 61733476
6-Pyrazol-1-ylpyridine-3-carboximidamide
CID 24709329
2-[4-[[[2-(Dimethylamino)-3-pyridinyl]methylamino]methyl]-3,5-dimethylpyrazol-1-yl]ethanol
CID 47615988
6-[4-[2-(2-Hydroxyethyl)pyrazol-3-yl]piperidin-1-yl]pyridine-3-carbonitrile
CID 51104281

Frequently Asked Questions

What is the IUPAC name of 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol?
The IUPAC name of 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol (CID 75430363) is 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol.
What is the SMILES notation for 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol?
The canonical SMILES for 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol is Cc1cnn(-c2cccc(N(CCO)CCCO)n2)c1.
What is the InChIKey of 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol?
The InChIKey is MQMGFJJQLLILCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-12-10-15-18(11-12)14-5-2-4-13(16-14)17(7-9-20)6-3-8-19/h2,4-5,10-11,19-20H,3,6-9H2,1H3.
What are the key properties of 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol?
3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol has a molecular weight of 276.34 g/mol, XLogP of 0.76, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydroxyethyl-[6-(4-methylpyrazol-1-yl)-2-pyridinyl]amino]propan-1-ol is sourced from PubChem (CID 75430363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).