N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide

C25H22N4O — CID 59399251

IUPACN-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide
SMILESCC(C)(c1cccc(C(=O)Nc2ccccc2)n1)c1cccc(-c2cccnc2)n1
InChIInChI=1S/C25H22N4O/c1-25(2,22-14-6-12-20(28-22)18-9-8-16-26-17-18)23-15-7-13-21(29-23)24(30)27-19-10-4-3-5-11-19/h3-17H,1-2H3,(H,27,30)
InChIKeyKTWAINSXVABEDB-UHFFFAOYSA-N
MW394.48 g/mol
LogP5.12
Rot. Bonds5

About N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide

N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide (PubChem CID 59399251) has the molecular formula C25H22N4O and a molecular weight of 394.48 g/mol. Its IUPAC name is N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide
PubChem CID59399251
Molecular FormulaC25H22N4O
Molecular Weight394.48 g/mol
Exact Mass394.18
IUPAC NameN-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide
SMILESCC(C)(c1cccc(C(=O)Nc2ccccc2)n1)c1cccc(-c2cccnc2)n1
InChIInChI=1S/C25H22N4O/c1-25(2,22-14-6-12-20(28-22)18-9-8-16-26-17-18)23-15-7-13-21(29-23)24(30)27-19-10-4-3-5-11-19/h3-17H,1-2H3,(H,27,30)
InChIKeyKTWAINSXVABEDB-UHFFFAOYSA-N
XLogP5.12
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.48
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[3-(prop-2-enoylamino)benzoyl]amino]phenyl]-6-pyridin-3-ylpyridine-2-carboxamide
CID 134557684
6-[2-(6-pyridin-3-ylpyrazin-2-yl)propan-2-yl]pyrazine-2-carboxylic acid
CID 59399288
ethane;6-methyl-N-(6-pyridin-3-yl-2-pyridinyl)pyridine-2-carboxamide
CID 143094222
CID 59472039
CID 59472039
2-phenyl-6-(2-pyridin-2-ylpropan-2-yl)pyridine
CID 58752837
2,6-dipyridin-3-ylpyridine
CID 13349632
7-chloro-8-methyl-N-phenyl-2-pyridin-3-ylquinoline-4-carboxamide
CID 2220481
N-(4-anilinophenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 47048043
2-N,9-N-dipyridin-3-yl-1,10-phenanthroline-2,9-dicarboxamide
CID 155927483
N,4-diphenylpyridine-3-carboxamide
CID 13115140
N,2-diphenylpyrimidine-4-carboxamide
CID 139433813
6-N-(3-methylphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099953

Frequently Asked Questions

What is the IUPAC name of N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide?
The IUPAC name of N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide (CID 59399251) is N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide is CC(C)(c1cccc(C(=O)Nc2ccccc2)n1)c1cccc(-c2cccnc2)n1.
What is the InChIKey of N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide?
The InChIKey is KTWAINSXVABEDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N4O/c1-25(2,22-14-6-12-20(28-22)18-9-8-16-26-17-18)23-15-7-13-21(29-23)24(30)27-19-10-4-3-5-11-19/h3-17H,1-2H3,(H,27,30).
What are the key properties of N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide?
N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 5.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-6-[2-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 59399251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).