2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol

C23H22N2O2 — CID 129137950

IUPAC2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol
SMILESCc1c(-c2ccccc2)cccc1-c1cc2cc(CNCCO)cnc2o1
InChIInChI=1S/C23H22N2O2/c1-16-20(18-6-3-2-4-7-18)8-5-9-21(16)22-13-19-12-17(14-24-10-11-26)15-25-23(19)27-22/h2-9,12-13,15,24,26H,10-11,14H2,1H3
InChIKeyUNWZQACEBMIMOT-UHFFFAOYSA-N
MW358.44 g/mol
LogP4.55
Rot. Bonds6

About 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol

2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol (PubChem CID 129137950) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol.

Molecular Properties

Compound Name2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol
PubChem CID129137950
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol
SMILESCc1c(-c2ccccc2)cccc1-c1cc2cc(CNCCO)cnc2o1
InChIInChI=1S/C23H22N2O2/c1-16-20(18-6-3-2-4-7-18)8-5-9-21(16)22-13-19-12-17(14-24-10-11-26)15-25-23(19)27-22/h2-9,12-13,15,24,26H,10-11,14H2,1H3
InChIKeyUNWZQACEBMIMOT-UHFFFAOYSA-N
XLogP4.55
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol with MolForge

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Related Compounds

L-754394
CID 5481990
Sgc-camkk2-1
CID 154700451
N-[(2S)-oxolan-2-ylmethyl]-2,3-diphenylfuro[2,3-b]pyridin-4-amine
CID 11603130
2-Cyclopentyl-4-(5-Phenylfuro[2,3-B]pyridin-3-Yl)benzoic Acid
CID 124222750
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-(furo[2,3-b]pyridin-2-ylmethyl)piperazine-2-carboxamide
CID 44342413
N-(4-ethoxyphenyl)-3-oxo-2-(pyridin-3-ylmethyl)isoindoline-4-carboxamide
CID 3238619
5-(3-(tert-butylcarbamoyl)phenyl)-2-(4-fluorophenyl)-N-methylfuro[2,3-b]pyridine-3-carboxamide
CID 59233666
[(1R)-2-(1-benzofuran-3-yl)-1-[(2-pyridin-4-ylacetyl)amino]ethyl]boronic acid
CID 140861708
[(1R)-2-(1-benzofuran-3-yl)-1-[(2-pyridin-3-ylacetyl)amino]ethyl]boronic acid
CID 140861720
(R)-2-(furan-2-yl)-N-(4-(2-(2-hydroxy-2-(pyridin-3-yl)ethylamino)ethyl)phenyl)benzamide
CID 46881980
4-(3-acetylphenyl)-N-(4-methoxyphenyl)-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
CID 49786753
N-benzyl-4-(3-carbamoylphenyl)-2-methyl-3H-furo[2,3-b]pyridine-2-carboxamide
CID 49786761

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol?
The IUPAC name of 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol (CID 129137950) is 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol.
What is the SMILES notation for 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol?
The canonical SMILES for 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol is Cc1c(-c2ccccc2)cccc1-c1cc2cc(CNCCO)cnc2o1.
What is the InChIKey of 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol?
The InChIKey is UNWZQACEBMIMOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-16-20(18-6-3-2-4-7-18)8-5-9-21(16)22-13-19-12-17(14-24-10-11-26)15-25-23(19)27-22/h2-9,12-13,15,24,26H,10-11,14H2,1H3.
What are the key properties of 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol?
2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol has a molecular weight of 358.44 g/mol, XLogP of 4.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methyl-3-phenylphenyl)furo[2,3-b]pyridin-5-yl]methylamino]ethanol is sourced from PubChem (CID 129137950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).