[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone

C19H25N5O2 — CID 124693146

IUPAC[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
SMILESC[C@@H]1CN(C(=O)c2cn(C3CCNCC3)nn2)C[C@@H](c2ccccc2)O1
InChIInChI=1S/C19H25N5O2/c1-14-11-23(13-18(26-14)15-5-3-2-4-6-15)19(25)17-12-24(22-21-17)16-7-9-20-10-8-16/h2-6,12,14,16,18,20H,7-11,13H2,1H3/t14-,18+/m1/s1
InChIKeyCHSLDDWCMCPSNC-KDOFPFPSSA-N
MW355.44 g/mol
LogP1.80
Rot. Bonds3

About [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone

[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone (PubChem CID 124693146) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone.

Molecular Properties

Compound Name[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
PubChem CID124693146
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
SMILESC[C@@H]1CN(C(=O)c2cn(C3CCNCC3)nn2)C[C@@H](c2ccccc2)O1
InChIInChI=1S/C19H25N5O2/c1-14-11-23(13-18(26-14)15-5-3-2-4-6-15)19(25)17-12-24(22-21-17)16-7-9-20-10-8-16/h2-6,12,14,16,18,20H,7-11,13H2,1H3/t14-,18+/m1/s1
InChIKeyCHSLDDWCMCPSNC-KDOFPFPSSA-N
XLogP1.80
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone with MolForge

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Related Compounds

(4-phenylpiperidin-1-yl)-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119703030
(2-methyl-4-phenylpyrrolidin-1-yl)-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119790919
1-(1-piperidin-4-yltriazole-4-carbonyl)azetidine-3-carboxylic acid
CID 79311734
(3-ethyl-4-phenylpiperidin-1-yl)-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119817651
[4-(N-methylanilino)piperidin-1-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119900181
(2-methylthiomorpholin-4-yl)-(1-piperidin-4-yltriazol-4-yl)methanone;hydrochloride
CID 119774179
(2-methyl-6-phenylmorpholin-4-yl)-pyrazin-2-ylmethanone
CID 47914748
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 94823256
[3-(diethylamino)pyrrolidin-1-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119843240
(2-phenylazepan-1-yl)-(1-piperidin-4-yltriazol-4-yl)methanone;hydrochloride
CID 119737784
[2-(2-chlorophenyl)-5-methylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119784336
[2-(3,4-difluorophenyl)morpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone
CID 119769790

Frequently Asked Questions

What is the IUPAC name of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone?
The IUPAC name of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone (CID 124693146) is [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone.
What is the SMILES notation for [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone?
The canonical SMILES for [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone is C[C@@H]1CN(C(=O)c2cn(C3CCNCC3)nn2)C[C@@H](c2ccccc2)O1.
What is the InChIKey of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone?
The InChIKey is CHSLDDWCMCPSNC-KDOFPFPSSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-14-11-23(13-18(26-14)15-5-3-2-4-6-15)19(25)17-12-24(22-21-17)16-7-9-20-10-8-16/h2-6,12,14,16,18,20H,7-11,13H2,1H3/t14-,18+/m1/s1.
What are the key properties of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone?
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone has a molecular weight of 355.44 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-(1-piperidin-4-yltriazol-4-yl)methanone is sourced from PubChem (CID 124693146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).