[2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol

C21H20N4O2 — CID 70676950

IUPAC[2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol
SMILESCc1ncc(CO)c2c(Nc3ccccn3)c(NCc3ccccc3)oc12
InChIInChI=1S/C21H20N4O2/c1-14-20-18(16(13-26)12-23-14)19(25-17-9-5-6-10-22-17)21(27-20)24-11-15-7-3-2-4-8-15/h2-10,12,24,26H,11,13H2,1H3,(H,22,25)
InChIKeyVFQDJJGNPILIHO-UHFFFAOYSA-N
MW360.42 g/mol
LogP4.38
Rot. Bonds6

About [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol

[2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol (PubChem CID 70676950) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol.

Molecular Properties

Compound Name[2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol
PubChem CID70676950
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name[2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol
SMILESCc1ncc(CO)c2c(Nc3ccccn3)c(NCc3ccccc3)oc12
InChIInChI=1S/C21H20N4O2/c1-14-20-18(16(13-26)12-23-14)19(25-17-9-5-6-10-22-17)21(27-20)24-11-15-7-3-2-4-8-15/h2-10,12,24,26H,11,13H2,1H3,(H,22,25)
InChIKeyVFQDJJGNPILIHO-UHFFFAOYSA-N
XLogP4.38
TPSA83.21 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 54.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

YM-201636
CID 9956222
3-(4-(4-Morpholinyl)pyrido(3',2':4,5)furo(3,2-d)pyrimidin-2-yl)phenol
CID 9884685
PI-103 (Hydrochloride)
CID 16739368
1-(4-benzoylpiperazin-1-yl)-2-[4-methoxy-7-[5-(methylamino)pyrazin-2-yl]-1H-pyrrolo[2,3-c]pyridin-3-yl]ethane-1,2-dione
CID 5280219
3-Amino-5-[4-(Morpholin-4-Yl)pyrido[3',2':4,5]furo[3,2-D]pyrimidin-2-Yl]phenol
CID 72376504
4-Morpholin-4-yl-pyrido[3'',2'':4,5]furo[3,2-d]pyrimidine
CID 44426432
4-Morpholin-4-yl-2-phenyl-pyrido[3'',2'':4,5]furo[3,2-d]pyrimidine
CID 44426435
2-[[4,4-Dimethyl-13-(pyridin-3-ylmethylamino)-11-oxa-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-8-yl]amino]ethanol
CID 56642530
6-(6-amino-3-pyridinyl)-N-(2-morpholin-4-yl-1,3-benzoxazol-6-yl)pyridine-2-carboxamide
CID 71542476
N3-(3-Chloro-4-fluorophenyl)-7-(2-morpholino-pyridin-4-yl)furo[2,3-c]pyridine-2,3-diamine
CID 117704863
2-(6-Morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)phenol
CID 136118009
4-(6-Morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)phenol;hydrochloride
CID 136179636

Frequently Asked Questions

What is the IUPAC name of [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
The IUPAC name of [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol (CID 70676950) is [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol.
What is the SMILES notation for [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
The canonical SMILES for [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol is Cc1ncc(CO)c2c(Nc3ccccn3)c(NCc3ccccc3)oc12.
What is the InChIKey of [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
The InChIKey is VFQDJJGNPILIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-14-20-18(16(13-26)12-23-14)19(25-17-9-5-6-10-22-17)21(27-20)24-11-15-7-3-2-4-8-15/h2-10,12,24,26H,11,13H2,1H3,(H,22,25).
What are the key properties of [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
[2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol has a molecular weight of 360.42 g/mol, XLogP of 4.38, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(benzylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol is sourced from PubChem (CID 70676950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).