2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide

C26H23N5O3 — CID 155348713

IUPAC2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2n1C1CCC(O)CC1)c1ccnc(-c2coc3cccnc23)c1
InChIInChI=1S/C26H23N5O3/c32-18-9-7-17(8-10-18)31-22-5-2-1-4-20(22)29-26(31)30-25(33)16-11-13-27-21(14-16)19-15-34-23-6-3-12-28-24(19)23/h1-6,11-15,17-18,32H,7-10H2,(H,29,30,33)
InChIKeyOUPHBEFWSHCHJK-UHFFFAOYSA-N
MW453.50 g/mol
LogP4.97
Rot. Bonds4

About 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide

2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide (PubChem CID 155348713) has the molecular formula C26H23N5O3 and a molecular weight of 453.50 g/mol. Its IUPAC name is 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide
PubChem CID155348713
Molecular FormulaC26H23N5O3
Molecular Weight453.50 g/mol
Exact Mass453.18
IUPAC Name2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2n1C1CCC(O)CC1)c1ccnc(-c2coc3cccnc23)c1
InChIInChI=1S/C26H23N5O3/c32-18-9-7-17(8-10-18)31-22-5-2-1-4-20(22)29-26(31)30-25(33)16-11-13-27-21(14-16)19-15-34-23-6-3-12-28-24(19)23/h1-6,11-15,17-18,32H,7-10H2,(H,29,30,33)
InChIKeyOUPHBEFWSHCHJK-UHFFFAOYSA-N
XLogP4.97
TPSA106.07 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.50
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide with MolForge

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Related Compounds

Serabelisib
CID 70798655
CA-4948
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CID 139593670
N-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]-2-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide
CID 139447554
1H-benzimidazol-2-yl-[4-[3-(4-hydroxypiperidin-1-yl)pyrazin-2-yl]oxyphenyl]methanone
CID 46208072
4-{9-cyclopentyl-6-[(6-furan-2-yl-pyridin-3-ylmethyl)-amino]-9H-purine-2-ylamino}-cyclohexanol
CID 71817798
N-(2-hydroxyethyl)-6-methoxy-1-[(6-methoxy-5-methyl-pyrimidin-4-yl)methyl]pyrrolo[3,2-b]pyridine-3-carboxamide
CID 90467159
1-[[6-(dimethylamino)-5-methyl-pyrimidin-4-yl]methyl]-N-(2-hydroxyethyl)-6-methoxy-pyrrolo[3,2-b]pyridine-3-carboxamide
CID 90467162
N-(5-cyclopropyl-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl)-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 91824142
N-[5-(4-hydroxypiperidin-1-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 118224418
4-(2-Furyl)-1-[(4-methoxyphenyl)methyl]imidazo[4,5-c]pyridine
CID 53249096
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Frequently Asked Questions

What is the IUPAC name of 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide?
The IUPAC name of 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide (CID 155348713) is 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide?
The canonical SMILES for 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide is O=C(Nc1nc2ccccc2n1C1CCC(O)CC1)c1ccnc(-c2coc3cccnc23)c1.
What is the InChIKey of 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide?
The InChIKey is OUPHBEFWSHCHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N5O3/c32-18-9-7-17(8-10-18)31-22-5-2-1-4-20(22)29-26(31)30-25(33)16-11-13-27-21(14-16)19-15-34-23-6-3-12-28-24(19)23/h1-6,11-15,17-18,32H,7-10H2,(H,29,30,33).
What are the key properties of 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide?
2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide has a molecular weight of 453.50 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-furo[3,2-b]pyridin-3-yl-N-[1-(4-hydroxycyclohexyl)benzimidazol-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 155348713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).