2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol

C19H22N4O2 — CID 110935658

IUPAC2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNc2cc(-c3ccccc3C)nn2CCO)n1
InChIInChI=1S/C19H22N4O2/c1-13-5-3-4-6-15(13)16-11-19(23(22-16)9-10-24)20-12-17-18(25)8-7-14(2)21-17/h3-8,11,20,24-25H,9-10,12H2,1-2H3
InChIKeyYUORFKBICYSGHH-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.87
Rot. Bonds6

About 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol

2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol (PubChem CID 110935658) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol
PubChem CID110935658
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNc2cc(-c3ccccc3C)nn2CCO)n1
InChIInChI=1S/C19H22N4O2/c1-13-5-3-4-6-15(13)16-11-19(23(22-16)9-10-24)20-12-17-18(25)8-7-14(2)21-17/h3-8,11,20,24-25H,9-10,12H2,1-2H3
InChIKeyYUORFKBICYSGHH-UHFFFAOYSA-N
XLogP2.87
TPSA83.20 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]phenol
CID 110928739
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CID 110924537
2-[5-(1H-imidazol-2-ylmethylamino)-3-(2-methylphenyl)pyrazol-1-yl]ethanol
CID 110929217
(1S,6S)-N-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]bicyclo[4.1.0]heptane-7-carboxamide
CID 99775066
1-cyclopropyl-3-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]urea
CID 52875986
N-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]-3-oxocyclobutane-1-carboxamide
CID 110004021
N-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]pent-4-enamide
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N-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]-2-propoxyacetamide
CID 110928306
N-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]-3-methyl-1,2-thiazole-4-carboxamide
CID 110027521
1-(4-hydroxycyclohexyl)-3-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]urea
CID 47090473
1-[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]-3-[(2R)-1-methoxypropan-2-yl]urea
CID 95282305
2-[[2-(difluoromethylsulfanyl)anilino]methyl]-6-methylpyridin-3-ol
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Frequently Asked Questions

What is the IUPAC name of 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol (CID 110935658) is 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol is Cc1ccc(O)c(CNc2cc(-c3ccccc3C)nn2CCO)n1.
What is the InChIKey of 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol?
The InChIKey is YUORFKBICYSGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-13-5-3-4-6-15(13)16-11-19(23(22-16)9-10-24)20-12-17-18(25)8-7-14(2)21-17/h3-8,11,20,24-25H,9-10,12H2,1-2H3.
What are the key properties of 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol?
2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol has a molecular weight of 338.41 g/mol, XLogP of 2.87, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 110935658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).