5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide

C23H24F2N4O — CID 131642650

IUPAC5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCC(C)n1cnc2c1C(C(=O)Nc1ccc(F)cc1F)N(Cc1ccccc1)CC2
InChIInChI=1S/C23H24F2N4O/c1-15(2)29-14-26-20-10-11-28(13-16-6-4-3-5-7-16)22(21(20)29)23(30)27-19-9-8-17(24)12-18(19)25/h3-9,12,14-15,22H,10-11,13H2,1-2H3,(H,27,30)
InChIKeyVDHWMRLCIAAYRH-UHFFFAOYSA-N
MW410.47 g/mol
LogP4.48
Rot. Bonds5

About 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide

5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide (PubChem CID 131642650) has the molecular formula C23H24F2N4O and a molecular weight of 410.47 g/mol. Its IUPAC name is 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide
PubChem CID131642650
Molecular FormulaC23H24F2N4O
Molecular Weight410.47 g/mol
Exact Mass410.19
IUPAC Name5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCC(C)n1cnc2c1C(C(=O)Nc1ccc(F)cc1F)N(Cc1ccccc1)CC2
InChIInChI=1S/C23H24F2N4O/c1-15(2)29-14-26-20-10-11-28(13-16-6-4-3-5-7-16)22(21(20)29)23(30)27-19-9-8-17(24)12-18(19)25/h3-9,12,14-15,22H,10-11,13H2,1-2H3,(H,27,30)
InChIKeyVDHWMRLCIAAYRH-UHFFFAOYSA-N
XLogP4.48
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-5-benzyl-N-(2-methoxy-3-pyridinyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide
CID 97361522
5-benzyl-N-(3-morpholin-4-ylpropyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide
CID 131660694
(5-benzyl-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-4-yl)-[4-(dimethylamino)piperidin-1-yl]methanone
CID 134075343
(4R)-5-benzyl-N-(2-methoxyethyl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide
CID 97442688
(3S)-1-benzyl-N-(2,4-difluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 2372506
3-(4-benzylpiperazin-1-yl)-N-(2,4-difluorophenyl)-3-oxopropanamide
CID 108949367
(2S)-2-(4-benzylpiperidin-1-yl)-N-(2,4-difluorophenyl)propanamide
CID 9430606
1-(1-benzylpiperidin-4-yl)-3-(2,4-difluorophenyl)urea
CID 972217
benzyl-[(2S)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl]-methylazanium
CID 9274668
(2S)-2-[benzyl-[(2,4-difluorophenyl)carbamoyl]amino]-N-hydroxy-3-methylbutanamide
CID 10833427
1-benzyl-N-(2,4-difluorophenyl)triazole-4-carboxamide
CID 18152169
4-N-(2,4-difluorophenyl)-1-N-(2-phenylethyl)cyclohexane-1,4-dicarboxamide
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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide?
The IUPAC name of 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide (CID 131642650) is 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide.
What is the SMILES notation for 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide?
The canonical SMILES for 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide is CC(C)n1cnc2c1C(C(=O)Nc1ccc(F)cc1F)N(Cc1ccccc1)CC2.
What is the InChIKey of 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide?
The InChIKey is VDHWMRLCIAAYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24F2N4O/c1-15(2)29-14-26-20-10-11-28(13-16-6-4-3-5-7-16)22(21(20)29)23(30)27-19-9-8-17(24)12-18(19)25/h3-9,12,14-15,22H,10-11,13H2,1-2H3,(H,27,30).
What are the key properties of 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide?
5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide has a molecular weight of 410.47 g/mol, XLogP of 4.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-N-(2,4-difluorophenyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4-carboxamide is sourced from PubChem (CID 131642650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).