(2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine

C14H25N3O — CID 125171682

IUPAC(2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine
SMILESCOCC[C@H]1CCCCN1Cc1nc(C)c(C)[nH]1
InChIInChI=1S/C14H25N3O/c1-11-12(2)16-14(15-11)10-17-8-5-4-6-13(17)7-9-18-3/h13H,4-10H2,1-3H3,(H,15,16)/t13-/m1/s1
InChIKeyNUSNRUCDCCOJBV-CYBMUJFWSA-N
MW251.37 g/mol
LogP2.42
Rot. Bonds5

About (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine

(2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine (PubChem CID 125171682) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine.

Molecular Properties

Compound Name(2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine
PubChem CID125171682
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name(2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine
SMILESCOCC[C@H]1CCCCN1Cc1nc(C)c(C)[nH]1
InChIInChI=1S/C14H25N3O/c1-11-12(2)16-14(15-11)10-17-8-5-4-6-13(17)7-9-18-3/h13H,4-10H2,1-3H3,(H,15,16)/t13-/m1/s1
InChIKeyNUSNRUCDCCOJBV-CYBMUJFWSA-N
XLogP2.42
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-2-(2-methoxyethyl)piperidine
CID 95132690
4-[[2-(2-methoxyethyl)piperidin-1-yl]methyl]-5-methyl-2-(2-methylphenyl)-1,3-oxazole
CID 45208474
2-(2,3-difluorophenyl)-4-[[(2R)-2-(2-methoxyethyl)piperidin-1-yl]methyl]-5-methyl-1,3-oxazole
CID 29181380
1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-2-(2-methoxyethyl)piperidine
CID 77096973
3-[2-[(2R)-2-(2-methoxyethyl)piperidin-1-yl]ethyl]-1H-imidazol-2-one
CID 124750793
2-(3-methoxypropyl)-1-[(2,4,6-trifluorophenyl)methyl]piperidine
CID 77084927
[2-ethoxy-5-[[2-(2-methoxyethyl)piperidin-1-yl]methyl]phenyl]methanol
CID 77082765
2-[[(2S)-2-(hydroxymethyl)piperidin-1-yl]methyl]-6,7-dimethoxy-3H-quinazolin-4-one
CID 135933558
2-[3-[[2-(2-methoxyethyl)piperidin-1-yl]methyl]phenoxy]acetamide
CID 77080552
[1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol
CID 47523985
2-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]-6-(5-methyl-1H-pyrazol-4-yl)-3H-thieno[3,2-d]pyrimidin-4-one
CID 138527138
[(2S)-2-(2-methoxyethyl)piperidin-1-yl]-[1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidin-4-yl]methanone
CID 26279760

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine?
The IUPAC name of (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine (CID 125171682) is (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine.
What is the SMILES notation for (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine?
The canonical SMILES for (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine is COCC[C@H]1CCCCN1Cc1nc(C)c(C)[nH]1.
What is the InChIKey of (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine?
The InChIKey is NUSNRUCDCCOJBV-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H25N3O/c1-11-12(2)16-14(15-11)10-17-8-5-4-6-13(17)7-9-18-3/h13H,4-10H2,1-3H3,(H,15,16)/t13-/m1/s1.
What are the key properties of (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine?
(2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine has a molecular weight of 251.37 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(4,5-dimethyl-1H-imidazol-2-yl)methyl]-2-(2-methoxyethyl)piperidine is sourced from PubChem (CID 125171682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).