1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol

C18H18Cl2N4O — CID 155447864

IUPAC1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol
SMILESCC1(O)CCN(c2ncc(-c3cccc(Cl)c3Cl)c3nccn23)CC1
InChIInChI=1S/C18H18Cl2N4O/c1-18(25)5-8-23(9-6-18)17-22-11-13(16-21-7-10-24(16)17)12-3-2-4-14(19)15(12)20/h2-4,7,10-11,25H,5-6,8-9H2,1H3
InChIKeyDPHDITBGWAUEQZ-UHFFFAOYSA-N
MW377.28 g/mol
LogP4.05
Rot. Bonds2

About 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol

1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol (PubChem CID 155447864) has the molecular formula C18H18Cl2N4O and a molecular weight of 377.28 g/mol. Its IUPAC name is 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol
PubChem CID155447864
Molecular FormulaC18H18Cl2N4O
Molecular Weight377.28 g/mol
Exact Mass376.09
IUPAC Name1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol
SMILESCC1(O)CCN(c2ncc(-c3cccc(Cl)c3Cl)c3nccn23)CC1
InChIInChI=1S/C18H18Cl2N4O/c1-18(25)5-8-23(9-6-18)17-22-11-13(16-21-7-10-24(16)17)12-3-2-4-14(19)15(12)20/h2-4,7,10-11,25H,5-6,8-9H2,1H3
InChIKeyDPHDITBGWAUEQZ-UHFFFAOYSA-N
XLogP4.05
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.28
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol 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 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol?
The IUPAC name of 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol (CID 155447864) is 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol?
The canonical SMILES for 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol is CC1(O)CCN(c2ncc(-c3cccc(Cl)c3Cl)c3nccn23)CC1.
What is the InChIKey of 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol?
The InChIKey is DPHDITBGWAUEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N4O/c1-18(25)5-8-23(9-6-18)17-22-11-13(16-21-7-10-24(16)17)12-3-2-4-14(19)15(12)20/h2-4,7,10-11,25H,5-6,8-9H2,1H3.
What are the key properties of 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol?
1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol has a molecular weight of 377.28 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-ol is sourced from PubChem (CID 155447864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).