(3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine

C19H21N3O — CID 124963811

IUPAC(3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine
SMILESCc1cnc([C@@H]2COCCN2Cc2cccc3ccccc23)[nH]1
InChIInChI=1S/C19H21N3O/c1-14-11-20-19(21-14)18-13-23-10-9-22(18)12-16-7-4-6-15-5-2-3-8-17(15)16/h2-8,11,18H,9-10,12-13H2,1H3,(H,20,21)/t18-/m0/s1
InChIKeyHSYYVQXORMXFBK-SFHVURJKSA-N
MW307.40 g/mol
LogP3.44
Rot. Bonds3

About (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine

(3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine (PubChem CID 124963811) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine.

Molecular Properties

Compound Name(3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine
PubChem CID124963811
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name(3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine
SMILESCc1cnc([C@@H]2COCCN2Cc2cccc3ccccc23)[nH]1
InChIInChI=1S/C19H21N3O/c1-14-11-20-19(21-14)18-13-23-10-9-22(18)12-16-7-4-6-15-5-2-3-8-17(15)16/h2-8,11,18H,9-10,12-13H2,1H3,(H,20,21)/t18-/m0/s1
InChIKeyHSYYVQXORMXFBK-SFHVURJKSA-N
XLogP3.44
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine?
The IUPAC name of (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine (CID 124963811) is (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine.
What is the SMILES notation for (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine?
The canonical SMILES for (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine is Cc1cnc([C@@H]2COCCN2Cc2cccc3ccccc23)[nH]1.
What is the InChIKey of (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine?
The InChIKey is HSYYVQXORMXFBK-SFHVURJKSA-N. The full InChI is InChI=1S/C19H21N3O/c1-14-11-20-19(21-14)18-13-23-10-9-22(18)12-16-7-4-6-15-5-2-3-8-17(15)16/h2-8,11,18H,9-10,12-13H2,1H3,(H,20,21)/t18-/m0/s1.
What are the key properties of (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine?
(3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine has a molecular weight of 307.40 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(5-methyl-1H-imidazol-2-yl)-4-(naphthalen-1-ylmethyl)morpholine is sourced from PubChem (CID 124963811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).