1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one

C16H20N4O2 — CID 167950185

IUPAC1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one
SMILESCc1ccc2oc(N3CCCC(N4CCNC4=O)C3)nc2c1
InChIInChI=1S/C16H20N4O2/c1-11-4-5-14-13(9-11)18-16(22-14)19-7-2-3-12(10-19)20-8-6-17-15(20)21/h4-5,9,12H,2-3,6-8,10H2,1H3,(H,17,21)
InChIKeyXRTWWDLPBXUIOO-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.13
Rot. Bonds2

About 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one

1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one (PubChem CID 167950185) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one
PubChem CID167950185
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one
SMILESCc1ccc2oc(N3CCCC(N4CCNC4=O)C3)nc2c1
InChIInChI=1S/C16H20N4O2/c1-11-4-5-14-13(9-11)18-16(22-14)19-7-2-3-12(10-19)20-8-6-17-15(20)21/h4-5,9,12H,2-3,6-8,10H2,1H3,(H,17,21)
InChIKeyXRTWWDLPBXUIOO-UHFFFAOYSA-N
XLogP2.13
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one 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

(3S)-4-(5-methyl-1,3-benzoxazol-2-yl)-3-propan-2-ylpiperazin-2-one
CID 97072010
2-[(3S)-3-[5-(imidazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-yl]-5-methyl-1,3-benzoxazole
CID 97198269
5-fluoro-2-(3-pyrrolidin-1-ylazepan-1-yl)-1,3-benzoxazole
CID 133314279
1-(5-methyl-1,3-benzoxazol-2-yl)pyrrolidine-3,4-dicarboxamide
CID 126836087
1-[1-(2-amino-6-chloropyrimidin-4-yl)piperidin-3-yl]imidazolidin-2-one
CID 47420600
1-[1-(5-bromo-3-pyridinyl)piperidin-3-yl]imidazolidin-2-one
CID 71926555
2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-5-methyl-1,3-benzoxazole
CID 127323044
1-(5-chloro-1,3-benzoxazol-2-yl)piperidin-3-amine;hydrochloride
CID 90484315
1-[(3R)-1-[(3R)-1-(4-methylphenyl)-2-oxopyrrolidin-3-yl]piperidin-3-yl]imidazolidin-2-one
CID 99846809
1-[1-(2-methylpyrimidin-4-yl)azetidin-3-yl]imidazolidin-2-one
CID 136543148
5-methyl-2-pyrrolidin-2-yl-1,3-benzoxazole
CID 60918724
1-[1-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)piperidin-3-yl]imidazolidin-2-one
CID 86808998

Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one (CID 167950185) is 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one is Cc1ccc2oc(N3CCCC(N4CCNC4=O)C3)nc2c1.
What is the InChIKey of 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one?
The InChIKey is XRTWWDLPBXUIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-11-4-5-14-13(9-11)18-16(22-14)19-7-2-3-12(10-19)20-8-6-17-15(20)21/h4-5,9,12H,2-3,6-8,10H2,1H3,(H,17,21).
What are the key properties of 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one?
1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one has a molecular weight of 300.36 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]imidazolidin-2-one is sourced from PubChem (CID 167950185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).