4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C18H25N5O — CID 70781068

IUPAC4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESCOCCn1ccnc1C1CCCN(c2ncnc3c2CCC3)C1
InChIInChI=1S/C18H25N5O/c1-24-11-10-22-9-7-19-17(22)14-4-3-8-23(12-14)18-15-5-2-6-16(15)20-13-21-18/h7,9,13-14H,2-6,8,10-12H2,1H3
InChIKeyJIIGYSACWZIFLW-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.19
Rot. Bonds5

About 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine

4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 70781068) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID70781068
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESCOCCn1ccnc1C1CCCN(c2ncnc3c2CCC3)C1
InChIInChI=1S/C18H25N5O/c1-24-11-10-22-9-7-19-17(22)14-4-3-8-23(12-14)18-15-5-2-6-16(15)20-13-21-18/h7,9,13-14H,2-6,8,10-12H2,1H3
InChIKeyJIIGYSACWZIFLW-UHFFFAOYSA-N
XLogP2.19
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine 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 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 70781068) is 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine is COCCn1ccnc1C1CCCN(c2ncnc3c2CCC3)C1.
What is the InChIKey of 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is JIIGYSACWZIFLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-24-11-10-22-9-7-19-17(22)14-4-3-8-23(12-14)18-15-5-2-6-16(15)20-13-21-18/h7,9,13-14H,2-6,8,10-12H2,1H3.
What are the key properties of 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 327.43 g/mol, XLogP of 2.19, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 70781068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).