(5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane

C16H23FN4O — CID 98776794

IUPAC(5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane
SMILESFc1cnc(N2CCC[C@]3(CCN([C@H]4CCOC4)C3)C2)nc1
InChIInChI=1S/C16H23FN4O/c17-13-8-18-15(19-9-13)21-5-1-3-16(12-21)4-6-20(11-16)14-2-7-22-10-14/h8-9,14H,1-7,10-12H2/t14-,16+/m0/s1
InChIKeyHPCIPRYVNUJZCO-GOEBONIOSA-N
MW306.38 g/mol
LogP1.70
Rot. Bonds2

About (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane

(5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane (PubChem CID 98776794) has the molecular formula C16H23FN4O and a molecular weight of 306.38 g/mol. Its IUPAC name is (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane
PubChem CID98776794
Molecular FormulaC16H23FN4O
Molecular Weight306.38 g/mol
Exact Mass306.19
IUPAC Name(5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane
SMILESFc1cnc(N2CCC[C@]3(CCN([C@H]4CCOC4)C3)C2)nc1
InChIInChI=1S/C16H23FN4O/c17-13-8-18-15(19-9-13)21-5-1-3-16(12-21)4-6-20(11-16)14-2-7-22-10-14/h8-9,14H,1-7,10-12H2/t14-,16+/m0/s1
InChIKeyHPCIPRYVNUJZCO-GOEBONIOSA-N
XLogP1.70
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4R,4aS,7aS)-6-ethyl-1-(5-fluoropyrimidin-2-yl)-4-methoxy-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine
CID 97423170
3-(5-Methylpyrimidin-2-yl)-11-propan-2-yl-8-oxa-3,11-diazaspiro[5.6]dodecane
CID 97502549
(4aR,7aS)-6-(cyclobutylmethyl)-4-(5-fluoropyrimidin-2-yl)-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine
CID 97510736
(4aR,7aS)-6-(cyclopentylmethyl)-4-(5-fluoropyrimidin-2-yl)-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine
CID 97510737
(4aR,7aS)-6-(cyclohexylmethyl)-4-(5-fluoropyrimidin-2-yl)-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine
CID 97510738
7-(5-Fluoropyrimidin-2-yl)-2-(2-methoxyethyl)-2,7-diazaspiro[4.5]decane
CID 118739101
(4aR,7aS)-4-(5-fluoropyrimidin-2-yl)-6-(oxolan-3-ylmethyl)-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine
CID 118739391
8-(Oxolan-3-ylmethyl)-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
CID 118745294
2-(2-Methoxyethyl)-7-pyrimidin-2-yl-2,7-diazaspiro[4.5]decane
CID 118745406
2-(Oxolan-3-ylmethyl)-8-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
CID 118745494
8-(2-Methoxyethyl)-3-(methoxymethyl)-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
CID 118746394
2-(5-Fluoro-4-morpholin-4-ylpyrimidin-2-yl)-8-methyl-2,8-diazaspiro[4.5]decane
CID 50979248

Frequently Asked Questions

What is the IUPAC name of (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane?
The IUPAC name of (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane (CID 98776794) is (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane.
What is the SMILES notation for (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane?
The canonical SMILES for (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane is Fc1cnc(N2CCC[C@]3(CCN([C@H]4CCOC4)C3)C2)nc1.
What is the InChIKey of (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane?
The InChIKey is HPCIPRYVNUJZCO-GOEBONIOSA-N. The full InChI is InChI=1S/C16H23FN4O/c17-13-8-18-15(19-9-13)21-5-1-3-16(12-21)4-6-20(11-16)14-2-7-22-10-14/h8-9,14H,1-7,10-12H2/t14-,16+/m0/s1.
What are the key properties of (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane?
(5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane has a molecular weight of 306.38 g/mol, XLogP of 1.70, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-7-(5-fluoropyrimidin-2-yl)-2-[(3S)-oxolan-3-yl]-2,7-diazaspiro[4.5]decane is sourced from PubChem (CID 98776794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).