4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine

C13H17N5O2 — CID 167925059

IUPAC4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine
SMILESCOc1ccnc(N[C@H]2CCO[C@@H]2c2nccn2C)n1
InChIInChI=1S/C13H17N5O2/c1-18-7-6-14-12(18)11-9(4-8-20-11)16-13-15-5-3-10(17-13)19-2/h3,5-7,9,11H,4,8H2,1-2H3,(H,15,16,17)/t9-,11-/m0/s1
InChIKeyDSQAMVWWQBBCPO-ONGXEEELSA-N
MW275.31 g/mol
LogP1.16
Rot. Bonds4

About 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine

4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine (PubChem CID 167925059) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine
PubChem CID167925059
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine
SMILESCOc1ccnc(N[C@H]2CCO[C@@H]2c2nccn2C)n1
InChIInChI=1S/C13H17N5O2/c1-18-7-6-14-12(18)11-9(4-8-20-11)16-13-15-5-3-10(17-13)19-2/h3,5-7,9,11H,4,8H2,1-2H3,(H,15,16,17)/t9-,11-/m0/s1
InChIKeyDSQAMVWWQBBCPO-ONGXEEELSA-N
XLogP1.16
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine 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

4-methoxy-N-(2-methyloxolan-3-yl)pyrimidin-2-amine
CID 112547989
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-4-phenylmethoxypyrimidin-2-amine
CID 128967970
6-methyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]imidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 128972404
(2S,3S)-N-[(2S)-1-(4-methoxyphenyl)propan-2-yl]-2-(1-methylimidazol-2-yl)oxolan-3-amine
CID 129475680
4-methoxy-N-[(2S,4R)-2-phenyloxan-4-yl]pyrimidin-2-amine
CID 124595523
6-methyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-4-amine
CID 128977675
N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]-6-(trifluoromethyl)pyridazin-3-amine
CID 154794373
4-methyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidine-2-carboxamide
CID 154738095
N-(2,3-dimethylcyclopentyl)-4-methoxypyrimidin-2-amine
CID 112637950
1-N-(4-methoxypyrimidin-2-yl)cyclopentane-1,2-diamine
CID 63252268
N-(2-methyloxolan-3-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 112638391
7-N-(4-methoxypyrimidin-2-yl)-2-oxabicyclo[3.2.0]heptane-6,7-diamine
CID 66195571

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine (CID 167925059) is 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine is COc1ccnc(N[C@H]2CCO[C@@H]2c2nccn2C)n1.
What is the InChIKey of 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine?
The InChIKey is DSQAMVWWQBBCPO-ONGXEEELSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-18-7-6-14-12(18)11-9(4-8-20-11)16-13-15-5-3-10(17-13)19-2/h3,5-7,9,11H,4,8H2,1-2H3,(H,15,16,17)/t9-,11-/m0/s1.
What are the key properties of 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine?
4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine has a molecular weight of 275.31 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrimidin-2-amine is sourced from PubChem (CID 167925059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).