(2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol

C16H25N5O — CID 95757591

IUPAC(2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol
SMILESCc1cc(C)n2cc(CN3CCN(C[C@@H](C)O)CC3)nc2n1
InChIInChI=1S/C16H25N5O/c1-12-8-13(2)21-11-15(18-16(21)17-12)10-20-6-4-19(5-7-20)9-14(3)22/h8,11,14,22H,4-7,9-10H2,1-3H3/t14-/m1/s1
InChIKeyOGWWRERKTWKSMO-CQSZACIVSA-N
MW303.41 g/mol
LogP0.84
Rot. Bonds4

About (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol

(2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol (PubChem CID 95757591) has the molecular formula C16H25N5O and a molecular weight of 303.41 g/mol. Its IUPAC name is (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol
PubChem CID95757591
Molecular FormulaC16H25N5O
Molecular Weight303.41 g/mol
Exact Mass303.21
IUPAC Name(2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol
SMILESCc1cc(C)n2cc(CN3CCN(C[C@@H](C)O)CC3)nc2n1
InChIInChI=1S/C16H25N5O/c1-12-8-13(2)21-11-15(18-16(21)17-12)10-20-6-4-19(5-7-20)9-14(3)22/h8,11,14,22H,4-7,9-10H2,1-3H3/t14-/m1/s1
InChIKeyOGWWRERKTWKSMO-CQSZACIVSA-N
XLogP0.84
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-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 (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
The IUPAC name of (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol (CID 95757591) is (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol.
What is the SMILES notation for (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
The canonical SMILES for (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol is Cc1cc(C)n2cc(CN3CCN(C[C@@H](C)O)CC3)nc2n1.
What is the InChIKey of (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
The InChIKey is OGWWRERKTWKSMO-CQSZACIVSA-N. The full InChI is InChI=1S/C16H25N5O/c1-12-8-13(2)21-11-15(18-16(21)17-12)10-20-6-4-19(5-7-20)9-14(3)22/h8,11,14,22H,4-7,9-10H2,1-3H3/t14-/m1/s1.
What are the key properties of (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
(2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol has a molecular weight of 303.41 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperazin-1-yl]propan-2-ol is sourced from PubChem (CID 95757591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).