4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine

C18H23N3O2 — CID 78151247

IUPAC4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine
SMILESCOc1cccc(-c2cnc(C3COCCN3CC3CC3)[nH]2)c1
InChIInChI=1S/C18H23N3O2/c1-22-15-4-2-3-14(9-15)16-10-19-18(20-16)17-12-23-8-7-21(17)11-13-5-6-13/h2-4,9-10,13,17H,5-8,11-12H2,1H3,(H,19,20)
InChIKeyLZSPHROJMVCRFO-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.87
Rot. Bonds5

About 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine

4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine (PubChem CID 78151247) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine.

Molecular Properties

Compound Name4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine
PubChem CID78151247
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine
SMILESCOc1cccc(-c2cnc(C3COCCN3CC3CC3)[nH]2)c1
InChIInChI=1S/C18H23N3O2/c1-22-15-4-2-3-14(9-15)16-10-19-18(20-16)17-12-23-8-7-21(17)11-13-5-6-13/h2-4,9-10,13,17H,5-8,11-12H2,1H3,(H,19,20)
InChIKeyLZSPHROJMVCRFO-UHFFFAOYSA-N
XLogP2.87
TPSA50.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenol
CID 78151252
(3R)-4-(cyclopropylmethyl)-3-(5-pyridin-3-yl-1H-imidazol-2-yl)morpholine
CID 71694177
(3R)-4-(1H-imidazol-5-ylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine
CID 71694244
4-[[3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]-N,N-dimethylaniline
CID 78151248
(3R)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]-4-[(1-methylbenzimidazol-2-yl)methyl]morpholine
CID 71694253
(3R)-3-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]-4-[(4-methylphenyl)methyl]morpholine
CID 56776036
(3R)-4-(cyclopropylmethyl)-3-[5-(2,4-difluorophenyl)-1H-imidazol-2-yl]morpholine
CID 71694155
(3R)-4-(2,2-dimethylpropyl)-3-(5-phenyl-1H-imidazol-2-yl)morpholine
CID 56775913
3-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]-4-(cyclopropylmethyl)morpholine
CID 78151125
4-[[(3R)-3-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]benzoic acid
CID 56776019
3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-4-methylmorpholine
CID 78151272
3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-4-[(4-methylsulfonylphenyl)methyl]morpholine
CID 78151281

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine?
The IUPAC name of 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine (CID 78151247) is 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine.
What is the SMILES notation for 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine?
The canonical SMILES for 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine is COc1cccc(-c2cnc(C3COCCN3CC3CC3)[nH]2)c1.
What is the InChIKey of 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine?
The InChIKey is LZSPHROJMVCRFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-22-15-4-2-3-14(9-15)16-10-19-18(20-16)17-12-23-8-7-21(17)11-13-5-6-13/h2-4,9-10,13,17H,5-8,11-12H2,1H3,(H,19,20).
What are the key properties of 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine?
4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine has a molecular weight of 313.40 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethyl)-3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholine is sourced from PubChem (CID 78151247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).