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

C20H24N4O2 — CID 70676948

IUPAC[2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol
SMILESCc1ncc(CO)c2c(Nc3ccccn3)c(NC3CCCCC3)oc12
InChIInChI=1S/C20H24N4O2/c1-13-19-17(14(12-25)11-22-13)18(24-16-9-5-6-10-21-16)20(26-19)23-15-7-3-2-4-8-15/h5-6,9-11,15,23,25H,2-4,7-8,12H2,1H3,(H,21,24)
InChIKeySCUULWWMQRHEKW-UHFFFAOYSA-N
MW352.44 g/mol
LogP4.51
Rot. Bonds5

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

[2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol (PubChem CID 70676948) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol.

Molecular Properties

Compound Name[2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol
PubChem CID70676948
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name[2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol
SMILESCc1ncc(CO)c2c(Nc3ccccn3)c(NC3CCCCC3)oc12
InChIInChI=1S/C20H24N4O2/c1-13-19-17(14(12-25)11-22-13)18(24-16-9-5-6-10-21-16)20(26-19)23-15-7-3-2-4-8-15/h5-6,9-11,15,23,25H,2-4,7-8,12H2,1H3,(H,21,24)
InChIKeySCUULWWMQRHEKW-UHFFFAOYSA-N
XLogP4.51
TPSA83.21 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 54.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
The IUPAC name of [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol (CID 70676948) is [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol.
What is the SMILES notation for [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
The canonical SMILES for [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol is Cc1ncc(CO)c2c(Nc3ccccn3)c(NC3CCCCC3)oc12.
What is the InChIKey of [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
The InChIKey is SCUULWWMQRHEKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-13-19-17(14(12-25)11-22-13)18(24-16-9-5-6-10-21-16)20(26-19)23-15-7-3-2-4-8-15/h5-6,9-11,15,23,25H,2-4,7-8,12H2,1H3,(H,21,24).
What are the key properties of [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol?
[2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol has a molecular weight of 352.44 g/mol, XLogP of 4.51, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexylamino)-7-methyl-3-(pyridin-2-ylamino)furo[2,3-c]pyridin-4-yl]methanol is sourced from PubChem (CID 70676948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).