2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide

C15H14F3N3O2 — CID 2200195

IUPAC2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(-c2ccccc2)nc1NCCO
InChIInChI=1S/C15H14F3N3O2/c16-15(17,18)10-8-11(9-4-2-1-3-5-9)21-14(20-6-7-22)12(10)13(19)23/h1-5,8,22H,6-7H2,(H2,19,23)(H,20,21)
InChIKeyAMOIOCCMKDUCBH-UHFFFAOYSA-N
MW325.29 g/mol
LogP2.27
Rot. Bonds5

About 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide

2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 2200195) has the molecular formula C15H14F3N3O2 and a molecular weight of 325.29 g/mol. Its IUPAC name is 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID2200195
Molecular FormulaC15H14F3N3O2
Molecular Weight325.29 g/mol
Exact Mass325.10
IUPAC Name2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(-c2ccccc2)nc1NCCO
InChIInChI=1S/C15H14F3N3O2/c16-15(17,18)10-8-11(9-4-2-1-3-5-9)21-14(20-6-7-22)12(10)13(19)23/h1-5,8,22H,6-7H2,(H2,19,23)(H,20,21)
InChIKeyAMOIOCCMKDUCBH-UHFFFAOYSA-N
XLogP2.27
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.29
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide (CID 2200195) is 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide is NC(=O)c1c(C(F)(F)F)cc(-c2ccccc2)nc1NCCO.
What is the InChIKey of 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is AMOIOCCMKDUCBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N3O2/c16-15(17,18)10-8-11(9-4-2-1-3-5-9)21-14(20-6-7-22)12(10)13(19)23/h1-5,8,22H,6-7H2,(H2,19,23)(H,20,21).
What are the key properties of 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 325.29 g/mol, XLogP of 2.27, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 2200195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).