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

C14H18N4O — CID 53192874

IUPACN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCc1noc(C)c1CCNc1ncnc2c1CCC2
InChIInChI=1S/C14H18N4O/c1-9-11(10(2)19-18-9)6-7-15-14-12-4-3-5-13(12)16-8-17-14/h8H,3-7H2,1-2H3,(H,15,16,17)
InChIKeySYHJAKYZAVAHHL-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.22
Rot. Bonds4

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

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 53192874) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID53192874
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCc1noc(C)c1CCNc1ncnc2c1CCC2
InChIInChI=1S/C14H18N4O/c1-9-11(10(2)19-18-9)6-7-15-14-12-4-3-5-13(12)16-8-17-14/h8H,3-7H2,1-2H3,(H,15,16,17)
InChIKeySYHJAKYZAVAHHL-UHFFFAOYSA-N
XLogP2.22
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 53192874) is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is Cc1noc(C)c1CCNc1ncnc2c1CCC2.
What is the InChIKey of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is SYHJAKYZAVAHHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-9-11(10(2)19-18-9)6-7-15-14-12-4-3-5-13(12)16-8-17-14/h8H,3-7H2,1-2H3,(H,15,16,17).
What are the key properties of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 258.32 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 53192874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).