[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol

C10H17N5O — CID 122491334

IUPAC[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
SMILESCNc1cc(N2CCC[C@@H]2CO)nc(N)n1
InChIInChI=1S/C10H17N5O/c1-12-8-5-9(14-10(11)13-8)15-4-2-3-7(15)6-16/h5,7,16H,2-4,6H2,1H3,(H3,11,12,13,14)/t7-/m1/s1
InChIKeyWYZZOFQQFKRCFP-SSDOTTSWSA-N
MW223.28 g/mol
LogP0.06
Rot. Bonds3

About [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol

[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol (PubChem CID 122491334) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
PubChem CID122491334
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
SMILESCNc1cc(N2CCC[C@@H]2CO)nc(N)n1
InChIInChI=1S/C10H17N5O/c1-12-8-5-9(14-10(11)13-8)15-4-2-3-7(15)6-16/h5,7,16H,2-4,6H2,1H3,(H3,11,12,13,14)/t7-/m1/s1
InChIKeyWYZZOFQQFKRCFP-SSDOTTSWSA-N
XLogP0.06
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

[1-[2-amino-6-(ethylamino)pyrimidin-4-yl]azepan-2-yl]methanol
CID 116640645
[1-(2,6-diaminopyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 80794344
[1-(2-amino-6-methylpyrimidin-4-yl)piperidin-2-yl]methanol
CID 112726024
[1-[6-(methylamino)-2-phenylpyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 115915425
6-(2-cyclopentylpyrrolidin-1-yl)-4-N-methylpyrimidine-2,4-diamine
CID 80819254
[1-[6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 80795011
[1-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]piperidin-2-yl]methanol
CID 106771022
1-[2-amino-6-(methylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80806770
2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol
CID 80927450
2-[1-[2-amino-6-(ethylamino)pyrimidin-4-yl]piperidin-2-yl]ethanol
CID 80767376
[1-(6-amino-2-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 80794639
6-[2-[(2-methoxyphenyl)methyl]piperidin-1-yl]-4-N-methylpyrimidine-2,4-diamine
CID 122456389

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol (CID 122491334) is [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol is CNc1cc(N2CCC[C@@H]2CO)nc(N)n1.
What is the InChIKey of [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
The InChIKey is WYZZOFQQFKRCFP-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H17N5O/c1-12-8-5-9(14-10(11)13-8)15-4-2-3-7(15)6-16/h5,7,16H,2-4,6H2,1H3,(H3,11,12,13,14)/t7-/m1/s1.
What are the key properties of [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol has a molecular weight of 223.28 g/mol, XLogP of 0.06, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 122491334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).