(2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine

C21H25N3O2 — CID 95403110

IUPAC(2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine
SMILESCOc1ccc2cc([C@@H]3CN(CCCn4cccn4)CCO3)ccc2c1
InChIInChI=1S/C21H25N3O2/c1-25-20-7-6-17-14-19(5-4-18(17)15-20)21-16-23(12-13-26-21)9-3-11-24-10-2-8-22-24/h2,4-8,10,14-15,21H,3,9,11-13,16H2,1H3/t21-/m0/s1
InChIKeyWBTVEPVXXKJDQM-NRFANRHFSA-N
MW351.45 g/mol
LogP3.51
Rot. Bonds6

About (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine

(2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine (PubChem CID 95403110) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine.

Molecular Properties

Compound Name(2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine
PubChem CID95403110
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC Name(2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine
SMILESCOc1ccc2cc([C@@H]3CN(CCCn4cccn4)CCO3)ccc2c1
InChIInChI=1S/C21H25N3O2/c1-25-20-7-6-17-14-19(5-4-18(17)15-20)21-16-23(12-13-26-21)9-3-11-24-10-2-8-22-24/h2,4-8,10,14-15,21H,3,9,11-13,16H2,1H3/t21-/m0/s1
InChIKeyWBTVEPVXXKJDQM-NRFANRHFSA-N
XLogP3.51
TPSA39.52 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-(6-methoxynaphthalen-2-yl)-4-(2-pyrazol-1-ylethyl)morpholine
CID 95545477
methyl 5-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]pentanoate
CID 56871644
2-(6-methoxynaphthalen-2-yl)-4-pyrimidin-2-ylmorpholine
CID 56878637
methyl 2-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]acetate
CID 95558883
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-2-(6-methoxynaphthalen-2-yl)morpholine
CID 56880097
2-(6-methoxynaphthalen-2-yl)-4-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]morpholine
CID 56918123
(2S)-2-[3-(difluoromethoxy)phenyl]-4-(2-pyrazol-1-ylethyl)morpholine
CID 124571996
(2S)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-(6-methoxynaphthalen-2-yl)morpholine
CID 95553263
(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-(6-methoxynaphthalen-2-yl)morpholine
CID 95553262
4-[[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methyl]-2-(6-methoxynaphthalen-2-yl)morpholine
CID 56877898
4-[[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methyl]-N-methyl-1,3-thiazol-2-amine
CID 56876335
1-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]butane-1,2-dione
CID 95562776

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine?
The IUPAC name of (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine (CID 95403110) is (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine.
What is the SMILES notation for (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine?
The canonical SMILES for (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine is COc1ccc2cc([C@@H]3CN(CCCn4cccn4)CCO3)ccc2c1.
What is the InChIKey of (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine?
The InChIKey is WBTVEPVXXKJDQM-NRFANRHFSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-25-20-7-6-17-14-19(5-4-18(17)15-20)21-16-23(12-13-26-21)9-3-11-24-10-2-8-22-24/h2,4-8,10,14-15,21H,3,9,11-13,16H2,1H3/t21-/m0/s1.
What are the key properties of (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine?
(2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine has a molecular weight of 351.45 g/mol, XLogP of 3.51, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(6-methoxynaphthalen-2-yl)-4-(3-pyrazol-1-ylpropyl)morpholine is sourced from PubChem (CID 95403110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).