6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide

C16H19N3O2 — CID 62181500

IUPAC6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccc(CCO)cc2)cn1
InChIInChI=1S/C16H19N3O2/c1-2-17-15-8-5-13(11-18-15)16(21)19-14-6-3-12(4-7-14)9-10-20/h3-8,11,20H,2,9-10H2,1H3,(H,17,18)(H,19,21)
InChIKeyXYANJJZKWJNOPU-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.30
Rot. Bonds6

About 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide

6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide (PubChem CID 62181500) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
PubChem CID62181500
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccc(CCO)cc2)cn1
InChIInChI=1S/C16H19N3O2/c1-2-17-15-8-5-13(11-18-15)16(21)19-14-6-3-12(4-7-14)9-10-20/h3-8,11,20H,2,9-10H2,1H3,(H,17,18)(H,19,21)
InChIKeyXYANJJZKWJNOPU-UHFFFAOYSA-N
XLogP2.30
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide (CID 62181500) is 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide is CCNc1ccc(C(=O)Nc2ccc(CCO)cc2)cn1.
What is the InChIKey of 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is XYANJJZKWJNOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-2-17-15-8-5-13(11-18-15)16(21)19-14-6-3-12(4-7-14)9-10-20/h3-8,11,20H,2,9-10H2,1H3,(H,17,18)(H,19,21).
What are the key properties of 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.30, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 62181500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).