(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine

C15H25N3O — CID 71694297

IUPAC(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine
SMILESCC(C)(C)c1cnc([C@@H]2COCCN2C2CCC2)[nH]1
InChIInChI=1S/C15H25N3O/c1-15(2,3)13-9-16-14(17-13)12-10-19-8-7-18(12)11-5-4-6-11/h9,11-12H,4-8,10H2,1-3H3,(H,16,17)/t12-/m0/s1
InChIKeyKMJVTVDSUMMNIX-LBPRGKRZSA-N
MW263.38 g/mol
LogP2.63
Rot. Bonds2

About (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine

(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine (PubChem CID 71694297) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine.

Molecular Properties

Compound Name(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine
PubChem CID71694297
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine
SMILESCC(C)(C)c1cnc([C@@H]2COCCN2C2CCC2)[nH]1
InChIInChI=1S/C15H25N3O/c1-15(2,3)13-9-16-14(17-13)12-10-19-8-7-18(12)11-5-4-6-11/h9,11-12H,4-8,10H2,1-3H3,(H,16,17)/t12-/m0/s1
InChIKeyKMJVTVDSUMMNIX-LBPRGKRZSA-N
XLogP2.63
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-(1-methylpiperidin-4-yl)morpholine
CID 71694279
1-[4-[(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)morpholin-4-yl]piperidin-1-yl]ethanone
CID 71694281
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-(oxan-4-yl)morpholine
CID 71694283
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-piperidin-4-ylmorpholine
CID 71694291
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclohexylmorpholine
CID 75367192
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-propan-2-ylmorpholine
CID 75367195
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-methylmorpholine
CID 75536200
(4-tert-butyl-1H-imidazol-2-yl)methanol hydrochloride
CID 132372510
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-(cyclopropylmethyl)morpholine
CID 71694286
(4-tert-butyl-1H-imidazol-2-yl)methanol
CID 23151525
N-methyl-N-[(2-methyl-1H-imidazol-4-yl)methyl]-4-morpholin-4-ylbutan-1-amine
CID 77083860
1-(5-tert-butyl-1H-imidazol-2-yl)-4-methylpiperazine
CID 57632541

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine?
The IUPAC name of (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine (CID 71694297) is (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine.
What is the SMILES notation for (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine?
The canonical SMILES for (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine is CC(C)(C)c1cnc([C@@H]2COCCN2C2CCC2)[nH]1.
What is the InChIKey of (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine?
The InChIKey is KMJVTVDSUMMNIX-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H25N3O/c1-15(2,3)13-9-16-14(17-13)12-10-19-8-7-18(12)11-5-4-6-11/h9,11-12H,4-8,10H2,1-3H3,(H,16,17)/t12-/m0/s1.
What are the key properties of (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine?
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine has a molecular weight of 263.38 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(5-tert-butyl-1H-imidazol-2-yl)-4-cyclobutylmorpholine is sourced from PubChem (CID 71694297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).