[(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol

C14H17N3O3 — CID 66641767

IUPAC[(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol
SMILESOC[C@@H]1CC[C@H](c2coc3c(NC4CC4)ncnc23)O1
InChIInChI=1S/C14H17N3O3/c18-5-9-3-4-11(20-9)10-6-19-13-12(10)15-7-16-14(13)17-8-1-2-8/h6-9,11,18H,1-5H2,(H,15,16,17)/t9-,11+/m0/s1
InChIKeyKHGRMJDQPBTXFQ-GXSJLCMTSA-N
MW275.31 g/mol
LogP2.01
Rot. Bonds4

About [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol

[(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol (PubChem CID 66641767) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol
PubChem CID66641767
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name[(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol
SMILESOC[C@@H]1CC[C@H](c2coc3c(NC4CC4)ncnc23)O1
InChIInChI=1S/C14H17N3O3/c18-5-9-3-4-11(20-9)10-6-19-13-12(10)15-7-16-14(13)17-8-1-2-8/h6-9,11,18H,1-5H2,(H,15,16,17)/t9-,11+/m0/s1
InChIKeyKHGRMJDQPBTXFQ-GXSJLCMTSA-N
XLogP2.01
TPSA80.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol with MolForge

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Related Compounds

[(2S,5R)-5-[4-(methylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol
CID 71017914
[(2R,5R)-5-[6-(cyclohexylamino)purin-9-yl]oxolan-2-yl]methanol
CID 54592375
(2S,3R,4S,5R)-2-[4-(2-hydroxyethylamino)furo[3,2-d]pyrimidin-7-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CID 11952930
[(2S,5R)-5-[[6-amino-5-(hydroxyamino)pyrimidin-4-yl]amino]oxolan-2-yl]methanol
CID 88887092
(2S,5S)-2-(4-aminofuro[3,2-d]pyrimidin-7-yl)-5-(hydroxymethyl)-3-methyloxolan-3-ol
CID 143157481
(2S,3R,4R,5R)-2-(4-hydrazinylfuro[3,2-d]pyrimidin-7-yl)-5-(2-hydroxyethyl)-3-methyloxolane-3,4-diol
CID 59859715
[(2S,5R)-5-(6-hydrazinylpurin-9-yl)oxolan-2-yl]methanol
CID 135258315
(2R,3R,4R,5S)-5-(4-aminofuro[3,2-d]pyrimidin-7-yl)-2-(hydroxymethyl)-4-methoxyoxolan-3-ol
CID 58676024
(2R,3S,4R,5S)-2-(hydroxymethyl)-5-[4-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]furo[3,2-d]pyrimidin-7-yl]oxolane-3,4-diol
CID 11952888
2-(4-aminofuro[3,2-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
CID 14886755
6-amino-5-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-1H-pyrimidin-2-one
CID 122656730
(2S,3R,4S,5R)-2-[4-(azetidin-1-yl)furo[3,2-d]pyrimidin-7-yl]-5-(hydroxymethyl)oxolane-3,4-diol
CID 11652458

Frequently Asked Questions

What is the IUPAC name of [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol?
The IUPAC name of [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol (CID 66641767) is [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol.
What is the SMILES notation for [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol?
The canonical SMILES for [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol is OC[C@@H]1CC[C@H](c2coc3c(NC4CC4)ncnc23)O1.
What is the InChIKey of [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol?
The InChIKey is KHGRMJDQPBTXFQ-GXSJLCMTSA-N. The full InChI is InChI=1S/C14H17N3O3/c18-5-9-3-4-11(20-9)10-6-19-13-12(10)15-7-16-14(13)17-8-1-2-8/h6-9,11,18H,1-5H2,(H,15,16,17)/t9-,11+/m0/s1.
What are the key properties of [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol?
[(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol has a molecular weight of 275.31 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5R)-5-[4-(cyclopropylamino)furo[3,2-d]pyrimidin-7-yl]oxolan-2-yl]methanol is sourced from PubChem (CID 66641767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).