(4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol

C11H19N3O — CID 84734392

IUPAC(4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol
SMILESCc1nc(C(O)C2CCNCC2)[nH]c1C
InChIInChI=1S/C11H19N3O/c1-7-8(2)14-11(13-7)10(15)9-3-5-12-6-4-9/h9-10,12,15H,3-6H2,1-2H3,(H,13,14)
InChIKeyDJKZZKOKVHWRLB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.06
Rot. Bonds2

About (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol

(4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol (PubChem CID 84734392) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol.

Molecular Properties

Compound Name(4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol
PubChem CID84734392
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name(4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol
SMILESCc1nc(C(O)C2CCNCC2)[nH]c1C
InChIInChI=1S/C11H19N3O/c1-7-8(2)14-11(13-7)10(15)9-3-5-12-6-4-9/h9-10,12,15H,3-6H2,1-2H3,(H,13,14)
InChIKeyDJKZZKOKVHWRLB-UHFFFAOYSA-N
XLogP1.06
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methyl-1H-indol-3-yl)-piperidin-4-ylmethanol
CID 43146530
1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-piperidin-4-ylethanol
CID 84736991
(3,5-dimethylthiophen-2-yl)-piperidin-4-ylmethanol
CID 81156188
piperidin-4-yl-(2,4,5-trimethylphenyl)methanol
CID 80503850
4-(5-methyl-2-propan-2-yl-1H-imidazol-4-yl)piperidine
CID 105461163
piperidin-4-yl(2H-triazol-4-yl)methanol
CID 84732454
(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol
CID 80560260
[4-(4-methoxyphenyl)phenyl]-piperidin-4-ylmethanol
CID 82341647
(4-chloro-3-methylphenyl)-piperidin-4-ylmethanol
CID 82341457
(5-chloro-4-methylthiophen-2-yl)-piperidin-4-ylmethanol
CID 102764357
3-piperidin-4-ylbutan-2-ol
CID 154192279
(2-methyl-1,3-thiazol-4-yl)-[(3S)-pyrrolidin-3-yl]methanol
CID 164653667

Frequently Asked Questions

What is the IUPAC name of (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol?
The IUPAC name of (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol (CID 84734392) is (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol.
What is the SMILES notation for (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol?
The canonical SMILES for (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol is Cc1nc(C(O)C2CCNCC2)[nH]c1C.
What is the InChIKey of (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol?
The InChIKey is DJKZZKOKVHWRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7-8(2)14-11(13-7)10(15)9-3-5-12-6-4-9/h9-10,12,15H,3-6H2,1-2H3,(H,13,14).
What are the key properties of (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol?
(4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol has a molecular weight of 209.29 g/mol, XLogP of 1.06, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5-dimethyl-1H-imidazol-2-yl)-piperidin-4-ylmethanol is sourced from PubChem (CID 84734392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).