2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide

C16H19N3O2 — CID 133322148

IUPAC2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1NCC(O)c1ccccc1C
InChIInChI=1S/C16H19N3O2/c1-11-6-3-4-7-12(11)14(20)10-19-15-13(16(21)17-2)8-5-9-18-15/h3-9,14,20H,10H2,1-2H3,(H,17,21)(H,18,19)
InChIKeyHJBFVYUHZOYANQ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.90
Rot. Bonds5

About 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide

2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide (PubChem CID 133322148) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide
PubChem CID133322148
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1NCC(O)c1ccccc1C
InChIInChI=1S/C16H19N3O2/c1-11-6-3-4-7-12(11)14(20)10-19-15-13(16(21)17-2)8-5-9-18-15/h3-9,14,20H,10H2,1-2H3,(H,17,21)(H,18,19)
InChIKeyHJBFVYUHZOYANQ-UHFFFAOYSA-N
XLogP1.90
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dihydroindol-1-yl-[2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-3-pyridinyl]methanone
CID 133342903
ethyl 2-[[2-hydroxy-2-(2-methoxyphenyl)ethyl]amino]pyridine-3-carboxylate
CID 47082819
2-[[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]amino]-N-methylpyridine-3-carboxamide
CID 133319504
2-[[3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]amino]-1-(2-methylphenyl)ethanol
CID 133342901
2-(methylamino)-1-(2-methylphenyl)ethanol
CID 14888492
N-methyl-2-[(1-methylcyclopentyl)methylamino]pyridine-3-carboxamide
CID 133321099
2-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylamino]-N-methylpyridine-3-carboxamide
CID 133345555
2-[[2-(4-bromoanilino)-2-oxoethyl]amino]-N-methylpyridine-3-carboxamide
CID 133328257
2-[[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenylethyl]amino]-N-methylpyridine-3-carboxamide
CID 133316958
N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide
CID 133328259
ethyl 2-[(2-hydroxy-4-methylpentyl)amino]pyridine-3-carboxylate
CID 104695418
2-[(6-chloro-3-pyridinyl)methylamino]-N-methylpyridine-3-carboxamide
CID 133319280

Frequently Asked Questions

What is the IUPAC name of 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide?
The IUPAC name of 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide (CID 133322148) is 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide?
The canonical SMILES for 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide is CNC(=O)c1cccnc1NCC(O)c1ccccc1C.
What is the InChIKey of 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide?
The InChIKey is HJBFVYUHZOYANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11-6-3-4-7-12(11)14(20)10-19-15-13(16(21)17-2)8-5-9-18-15/h3-9,14,20H,10H2,1-2H3,(H,17,21)(H,18,19).
What are the key properties of 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide?
2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.90, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 133322148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).