1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol

C10H14ClN3O — CID 130921256

IUPAC1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol
SMILESCc1nc(Cl)cc(N2CC(O)CC2C)n1
InChIInChI=1S/C10H14ClN3O/c1-6-3-8(15)5-14(6)10-4-9(11)12-7(2)13-10/h4,6,8,15H,3,5H2,1-2H3
InChIKeyGLVPDUNUEVTTTR-UHFFFAOYSA-N
MW227.69 g/mol
LogP1.40
Rot. Bonds1

About 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol

1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol (PubChem CID 130921256) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol
PubChem CID130921256
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol
SMILESCc1nc(Cl)cc(N2CC(O)CC2C)n1
InChIInChI=1S/C10H14ClN3O/c1-6-3-8(15)5-14(6)10-4-9(11)12-7(2)13-10/h4,6,8,15H,3,5H2,1-2H3
InChIKeyGLVPDUNUEVTTTR-UHFFFAOYSA-N
XLogP1.40
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(6-chloro-2-methylpyrimidin-4-yl)-5-(hydroxymethyl)pyrrolidin-3-yl]methanol
CID 139019006
(2S,6S)-4-(6-chloro-2-methylpyrimidin-4-yl)-2,6-dimethylmorpholine
CID 129367907
1-(6-aminopyrazin-2-yl)-5-methylpyrrolidin-3-ol
CID 126989530
1-(3-chloropyrazin-2-yl)-5-methylpyrrolidin-3-ol
CID 130993857
[1-(6-chloro-2-methylpyrimidin-4-yl)-4-methylpyrrolidin-3-yl]methanol
CID 121202573
1-[1-(6-chloro-2-methylpyrimidin-4-yl)pyrrolidin-2-yl]ethanol
CID 121201735
(1R)-1-[(2S)-1-(6-chloro-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanol
CID 129499743
5-(6-chloro-2-methylpyrimidin-4-yl)-2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 121205987
(3aS,6aS)-2-(6-chloro-2-methylpyrimidin-4-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 129381760
1-(6-amino-2-methylpyrimidin-4-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 80856423
[4-(6-chloro-2-methylpyrimidin-4-yl)-6-methylmorpholin-2-yl]methanol
CID 102933937
[(3R)-1-(6-chloro-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]methanol
CID 129393742

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol?
The IUPAC name of 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol (CID 130921256) is 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol.
What is the SMILES notation for 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol?
The canonical SMILES for 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol is Cc1nc(Cl)cc(N2CC(O)CC2C)n1.
What is the InChIKey of 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol?
The InChIKey is GLVPDUNUEVTTTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c1-6-3-8(15)5-14(6)10-4-9(11)12-7(2)13-10/h4,6,8,15H,3,5H2,1-2H3.
What are the key properties of 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol?
1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol has a molecular weight of 227.69 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-2-methylpyrimidin-4-yl)-5-methylpyrrolidin-3-ol is sourced from PubChem (CID 130921256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).