N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide

C19H18N4O — CID 113013043

IUPACN-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(NCCc2ccccc2)nc1)c1cccnc1
InChIInChI=1S/C19H18N4O/c24-19(16-7-4-11-20-13-16)23-17-8-9-18(22-14-17)21-12-10-15-5-2-1-3-6-15/h1-9,11,13-14H,10,12H2,(H,21,22)(H,23,24)
InChIKeyYXXFOYAJFILTSG-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.38
Rot. Bonds6

About N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide

N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 113013043) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide
PubChem CID113013043
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC NameN-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(NCCc2ccccc2)nc1)c1cccnc1
InChIInChI=1S/C19H18N4O/c24-19(16-7-4-11-20-13-16)23-17-8-9-18(22-14-17)21-12-10-15-5-2-1-3-6-15/h1-9,11,13-14H,10,12H2,(H,21,22)(H,23,24)
InChIKeyYXXFOYAJFILTSG-UHFFFAOYSA-N
XLogP3.38
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-hydroxypropylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 28901850
3,4-dimethyl-N-[6-(2-phenylethylamino)-3-pyridinyl]benzamide
CID 113013026
N-[6-[2-(2,4-dichlorophenyl)ethylamino]-3-pyridinyl]pyridine-3-carboxamide
CID 113015856
N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 43812722
N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158260
N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160785
N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158234
N-(1,3-benzodioxol-5-yl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158270
N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide
CID 113025065
3-fluoro-N-[6-(pyridin-3-ylmethylamino)-3-pyridinyl]benzamide
CID 113012780
N-[5-[2-(dimethylamino)ethylamino]-2-pyridinyl]pyridine-3-carboxamide
CID 113025531
N-(4-tert-butylphenyl)-6-(pyridin-3-ylmethylamino)pyridine-3-carboxamide
CID 109157873

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide (CID 113013043) is N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide is O=C(Nc1ccc(NCCc2ccccc2)nc1)c1cccnc1.
What is the InChIKey of N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is YXXFOYAJFILTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c24-19(16-7-4-11-20-13-16)23-17-8-9-18(22-14-17)21-12-10-15-5-2-1-3-6-15/h1-9,11,13-14H,10,12H2,(H,21,22)(H,23,24).
What are the key properties of N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide?
N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 3.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 113013043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).