N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide

C24H23N3O2 — CID 59812101

IUPACN-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide
SMILESO=C(NC1CCCCC1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1
InChIInChI=1S/C24H23N3O2/c28-24(27-18-6-2-1-3-7-18)20-9-5-4-8-19(20)17-12-21-22(16-10-11-29-15-16)14-26-23(21)25-13-17/h4-5,8-15,18H,1-3,6-7H2,(H,25,26)(H,27,28)
InChIKeyYVYGIKDVINZQGC-UHFFFAOYSA-N
MW385.47 g/mol
LogP5.55
Rot. Bonds4

About N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide

N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide (PubChem CID 59812101) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide
PubChem CID59812101
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC NameN-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide
SMILESO=C(NC1CCCCC1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1
InChIInChI=1S/C24H23N3O2/c28-24(27-18-6-2-1-3-7-18)20-9-5-4-8-19(20)17-12-21-22(16-10-11-29-15-16)14-26-23(21)25-13-17/h4-5,8-15,18H,1-3,6-7H2,(H,25,26)(H,27,28)
InChIKeyYVYGIKDVINZQGC-UHFFFAOYSA-N
XLogP5.55
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.47
LogP ≤ 55.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
CID 11218431
3-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzaldehyde
CID 175416952
5-(2-fluoro-3-pyridinyl)-N-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 156501633
N-benzyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]furan-2-carboxamide;N-cyclohexyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]furan-2-carboxamide;N-(cyclopropylmethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]furan-2-carboxamide;N-[2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]acetamide;N-[2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanesulfinamide;N-(2-hydroxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]furan-2-carboxamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylfuran-2-carboxamide
CID 160932921
3-(furan-3-yl)-5-(3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 10379453
2,3-dihydropyrrol-1-yl-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]methanone
CID 143099156
3-(furan-3-yl)-N-(1H-indol-5-yl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 11244786
N-cyclooctyl-2-(naphthalen-1-ylamino)benzamide
CID 17385247
N-(4-hydroxycyclohexyl)-2-phenylbenzamide
CID 39903813
N-cyclohexyl-6-phenylpyridazine-3-carboxamide
CID 113200519
N-cyclopentyl-4-[5-(2-methylsulfanylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine
CID 129206908
N-[2-(cyclohexylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 4922643

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide?
The IUPAC name of N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide (CID 59812101) is N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide.
What is the SMILES notation for N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide?
The canonical SMILES for N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide is O=C(NC1CCCCC1)c1ccccc1-c1cnc2[nH]cc(-c3ccoc3)c2c1.
What is the InChIKey of N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide?
The InChIKey is YVYGIKDVINZQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c28-24(27-18-6-2-1-3-7-18)20-9-5-4-8-19(20)17-12-21-22(16-10-11-29-15-16)14-26-23(21)25-13-17/h4-5,8-15,18H,1-3,6-7H2,(H,25,26)(H,27,28).
What are the key properties of N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide?
N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide has a molecular weight of 385.47 g/mol, XLogP of 5.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide is sourced from PubChem (CID 59812101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).