[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol

C12H19N3O2 — CID 83184634

IUPAC[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol
SMILESCc1nc(N(C)C2CCOC2C)ncc1CO
InChIInChI=1S/C12H19N3O2/c1-8-10(7-16)6-13-12(14-8)15(3)11-4-5-17-9(11)2/h6,9,11,16H,4-5,7H2,1-3H3
InChIKeyLUOQOXJPKCAICG-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.89
Rot. Bonds3

About [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol

[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol (PubChem CID 83184634) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol
PubChem CID83184634
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol
SMILESCc1nc(N(C)C2CCOC2C)ncc1CO
InChIInChI=1S/C12H19N3O2/c1-8-10(7-16)6-13-12(14-8)15(3)11-4-5-17-9(11)2/h6,9,11,16H,4-5,7H2,1-3H3
InChIKeyLUOQOXJPKCAICG-UHFFFAOYSA-N
XLogP0.89
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-methyl-2-[methyl(oxan-4-yl)amino]pyrimidin-5-yl]methanol
CID 83184886
[2-[(1,1-dioxothiolan-3-yl)-methylamino]-4-methylpyrimidin-5-yl]methanol
CID 83183846
5-(2-aminoethyl)-N-methyl-N-(2-methyloxolan-3-yl)pyrimidin-2-amine
CID 113388563
[2-[cyclopropyl(ethyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83183763
[2-[cyclohexylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184195
5-(ethylaminomethyl)-N,2-dimethyl-N-(2-methyloxolan-3-yl)pyridin-4-amine
CID 82754776
4-N,5-dimethyl-4-N-(2-methyloxolan-3-yl)pyrimidine-2,4-diamine
CID 82745889
[4-chloro-2-[methyl-(2-methyloxolan-3-yl)amino]phenyl]methanol
CID 114845807
[2-(diethylamino)-4-methylpyrimidin-5-yl]methanol
CID 83183758
2-[cyclopentyl-[5-(hydroxymethyl)-4-methylpyrimidin-2-yl]amino]ethanol
CID 83184371
N,6-dimethyl-N-(2-methyloxolan-3-yl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 82754773
2-N,4-N,5-trimethyl-4-N-(2-methyloxolan-3-yl)pyrimidine-2,4-diamine
CID 82744646

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol?
The IUPAC name of [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol (CID 83184634) is [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol.
What is the SMILES notation for [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol?
The canonical SMILES for [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol is Cc1nc(N(C)C2CCOC2C)ncc1CO.
What is the InChIKey of [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol?
The InChIKey is LUOQOXJPKCAICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-8-10(7-16)6-13-12(14-8)15(3)11-4-5-17-9(11)2/h6,9,11,16H,4-5,7H2,1-3H3.
What are the key properties of [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol?
[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol has a molecular weight of 237.30 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]pyrimidin-5-yl]methanol is sourced from PubChem (CID 83184634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).