[(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol

C20H29N3O2 — CID 95707377

IUPAC[(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol
SMILESCOc1ccc(-c2nccn2CCN2CCCC[C@@H]2CO)c(C)c1C
InChIInChI=1S/C20H29N3O2/c1-15-16(2)19(25-3)8-7-18(15)20-21-9-11-23(20)13-12-22-10-5-4-6-17(22)14-24/h7-9,11,17,24H,4-6,10,12-14H2,1-3H3/t17-/m1/s1
InChIKeyIAXAFMMROXJGPI-QGZVFWFLSA-N
MW343.47 g/mol
LogP3.02
Rot. Bonds6

About [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol

[(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol (PubChem CID 95707377) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol
PubChem CID95707377
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name[(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol
SMILESCOc1ccc(-c2nccn2CCN2CCCC[C@@H]2CO)c(C)c1C
InChIInChI=1S/C20H29N3O2/c1-15-16(2)19(25-3)8-7-18(15)20-21-9-11-23(20)13-12-22-10-5-4-6-17(22)14-24/h7-9,11,17,24H,4-6,10,12-14H2,1-3H3/t17-/m1/s1
InChIKeyIAXAFMMROXJGPI-QGZVFWFLSA-N
XLogP3.02
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol with MolForge

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Related Compounds

(2-Methoxynaphthalen-1-yl)-(1-methylimidazol-2-yl)methanol
CID 2904872
(1-benzyl-1H-imidazol-2-yl)(4-methoxyphenyl)methanol
CID 3244151
(2S,3S)-N-[[2-methoxy-5-(1-methylimidazol-2-yl)phenyl]methyl]-2-phenylpiperidin-3-amine
CID 11793946
2-(1-(4-methoxy-2,3-dimethylbenzyl)-4-{[1-(2-pyrimidinyl)-1H-pyrrol-2-yl]methyl}-2-piperazinyl)ethanol
CID 16191619
(1-Ethylimidazol-2-yl)-(3-methoxyphenyl)methanol
CID 2890946
[1-[(1-ethyl-1H-imidazol-2-yl)methyl]-3-(3-methoxybenzyl)-3-piperidinyl]methanol
CID 16190200
2-(1H-Imidazol-1-yl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 13135481
(3S,4R)-3-Hydroxy-2,2-dimethyl-4-(2-phenyl-imidazol-1-yl)-chroman-6-carbonitrile
CID 44564206
2-[2-(2-fluoro-4,5-dimethoxyphenyl)-1H-imidazol-1-yl]-1-phenylethanol
CID 70704619
2-(4-(4-methoxyphenyl)-2-(pyridin-4-yl)-1H-imidazol-1-yl)ethanol
CID 25102507
2-[4-[[4-[(1-Methylimidazol-2-yl)methoxy]phenyl]methyl]piperazin-1-yl]ethanol
CID 52672142
1-[(2-Methoxy-5-methylphenyl)methyl]-4-[(1-methylimidazol-2-yl)methyl]piperazine
CID 53519602

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol?
The IUPAC name of [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol (CID 95707377) is [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol is COc1ccc(-c2nccn2CCN2CCCC[C@@H]2CO)c(C)c1C.
What is the InChIKey of [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol?
The InChIKey is IAXAFMMROXJGPI-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-15-16(2)19(25-3)8-7-18(15)20-21-9-11-23(20)13-12-22-10-5-4-6-17(22)14-24/h7-9,11,17,24H,4-6,10,12-14H2,1-3H3/t17-/m1/s1.
What are the key properties of [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol?
[(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol has a molecular weight of 343.47 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[2-[2-(4-methoxy-2,3-dimethylphenyl)imidazol-1-yl]ethyl]piperidin-2-yl]methanol is sourced from PubChem (CID 95707377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).