2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C12H14N4O — CID 62201733

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCc1noc(C)c1-c1nc(N)c2c(n1)CCC2
InChIInChI=1S/C12H14N4O/c1-6-10(7(2)17-16-6)12-14-9-5-3-4-8(9)11(13)15-12/h3-5H2,1-2H3,(H2,13,14,15)
InChIKeyQXQZHAJKFLFWEB-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.82
Rot. Bonds1

About 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 62201733) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID62201733
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCc1noc(C)c1-c1nc(N)c2c(n1)CCC2
InChIInChI=1S/C12H14N4O/c1-6-10(7(2)17-16-6)12-14-9-5-3-4-8(9)11(13)15-12/h3-5H2,1-2H3,(H2,13,14,15)
InChIKeyQXQZHAJKFLFWEB-UHFFFAOYSA-N
XLogP1.82
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine with MolForge

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Related Compounds

N-cyclopentyl-3-ethyl-6-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 53004454
N-[3-(3,5-dimethyl-4-isoxazolyl)propyl]-2-ethyl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine dihydrochloride
CID 56895371
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-5-fluoro-6-methylpyrimidin-4-amine
CID 65998628
[2-(3,5-Dimethyl-1,2-oxazol-4-yl)-5-fluoro-6-methylpyrimidin-4-yl]hydrazine
CID 65998663
2-(3,5-dimethyl-1,2-oxazol-4-yl)-5-fluoro-6-methyl-N-propylpyrimidin-4-amine
CID 65999630
2-(3,5-dimethyl-1,2-oxazol-4-yl)-5-fluoro-N,6-dimethylpyrimidin-4-amine
CID 65999818
2-(3,5-Dimethyl-1,2-oxazol-4-yl)-5-fluoro-6-methylpyrimidin-4-amine
CID 66000408
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6-ethyl-5-fluoropyrimidin-4-amine
CID 103880149
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-5-fluoropyrimidin-4-amine
CID 113344328
N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-5-fluoropyrimidin-4-amine
CID 133419437
2-(3,5-Dimethyl-1,2-oxazol-4-yl)-6-methylpyrimidin-4-amine
CID 62201740
4-N-cyclohexyl-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5,6-dimethylpyrimidine-2,4-diamine
CID 71738404

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 62201733) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is Cc1noc(C)c1-c1nc(N)c2c(n1)CCC2.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is QXQZHAJKFLFWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-6-10(7(2)17-16-6)12-14-9-5-3-4-8(9)11(13)15-12/h3-5H2,1-2H3,(H2,13,14,15).
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 230.27 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 62201733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).