(3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol

C10H15N3O2 — CID 176625763

IUPAC(3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol
SMILESCOCc1ccnc(N2CC[C@@H](O)C2)n1
InChIInChI=1S/C10H15N3O2/c1-15-7-8-2-4-11-10(12-8)13-5-3-9(14)6-13/h2,4,9,14H,3,5-7H2,1H3/t9-/m1/s1
InChIKeyWXPUWKRTCFNGSQ-SECBINFHSA-N
MW209.25 g/mol
LogP0.19
Rot. Bonds3

About (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol

(3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol (PubChem CID 176625763) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol
PubChem CID176625763
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name(3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol
SMILESCOCc1ccnc(N2CC[C@@H](O)C2)n1
InChIInChI=1S/C10H15N3O2/c1-15-7-8-2-4-11-10(12-8)13-5-3-9(14)6-13/h2,4,9,14H,3,5-7H2,1H3/t9-/m1/s1
InChIKeyWXPUWKRTCFNGSQ-SECBINFHSA-N
XLogP0.19
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S)-1-[4-[[4-[1-(4-methylphenyl)cyclobutyl]phenoxy]methyl]pyrimidin-2-yl]pyrrolidin-3-ol
CID 176625993
2-[(3R)-3-hydroxypyrrolidin-1-yl]pyrimidine-4-carboxamide
CID 123733519
[2-(3-methoxypyrrolidin-1-yl)pyrimidin-4-yl]methanamine
CID 107542321
2-[4-(methoxymethyl)pyrimidin-2-yl]-6-methyl-2,6-diazaspiro[3.3]heptane
CID 176625990
[2-(3-ethylpyrrolidin-1-yl)pyrimidin-4-yl]methanamine
CID 107542226
(3R)-1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl]pyrrolidin-3-ol
CID 95137462
1-(4-aminopyrimidin-2-yl)-4-(2-methoxyethoxy)piperidin-3-ol
CID 156538204
[2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)pyrimidin-4-yl]methanamine
CID 107542111
(3R)-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)pyrrolidin-3-ol
CID 103696650
1-[2-(3-pyridin-3-ylazetidin-1-yl)pyrimidin-4-yl]pyrrolidin-3-ol
CID 56897191
(3S,4R)-1-(4-aminopyrimidin-2-yl)-4-methoxypiperidin-3-ol
CID 156538124
1-[6-(propan-2-yloxymethyl)-2-pyridinyl]pyrrolidin-3-ol
CID 164738532

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol?
The IUPAC name of (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol (CID 176625763) is (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol.
What is the SMILES notation for (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol?
The canonical SMILES for (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol is COCc1ccnc(N2CC[C@@H](O)C2)n1.
What is the InChIKey of (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol?
The InChIKey is WXPUWKRTCFNGSQ-SECBINFHSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-15-7-8-2-4-11-10(12-8)13-5-3-9(14)6-13/h2,4,9,14H,3,5-7H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol?
(3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol has a molecular weight of 209.25 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[4-(methoxymethyl)pyrimidin-2-yl]pyrrolidin-3-ol is sourced from PubChem (CID 176625763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).