(2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide

C19H26N2O3 — CID 124999466

IUPAC(2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide
SMILESCNC(=O)[C@]1(C)CN(C(=O)Cc2ccc3c(c2)CCCC3)CCO1
InChIInChI=1S/C19H26N2O3/c1-19(18(23)20-2)13-21(9-10-24-19)17(22)12-14-7-8-15-5-3-4-6-16(15)11-14/h7-8,11H,3-6,9-10,12-13H2,1-2H3,(H,20,23)/t19-/m0/s1
InChIKeyRPBNFKOPJOYTKQ-IBGZPJMESA-N
MW330.43 g/mol
LogP1.47
Rot. Bonds3

About (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide

(2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide (PubChem CID 124999466) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide
PubChem CID124999466
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC Name(2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide
SMILESCNC(=O)[C@]1(C)CN(C(=O)Cc2ccc3c(c2)CCCC3)CCO1
InChIInChI=1S/C19H26N2O3/c1-19(18(23)20-2)13-21(9-10-24-19)17(22)12-14-7-8-15-5-3-4-6-16(15)11-14/h7-8,11H,3-6,9-10,12-13H2,1-2H3,(H,20,23)/t19-/m0/s1
InChIKeyRPBNFKOPJOYTKQ-IBGZPJMESA-N
XLogP1.47
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide with MolForge

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Related Compounds

(2R)-4-[2-(4-chlorophenyl)acetyl]-N,2-dimethylmorpholine-2-carboxamide
CID 95839493
4-[2-methyl-2-(methylcarbamoyl)morpholin-4-yl]-4-oxobutanoic acid
CID 110106954
(2R)-2-methyl-4-(2-naphthalen-2-ylacetyl)morpholine-2-carboxamide
CID 124986005
(2R)-4-[2-(methanesulfonamido)acetyl]-N,2-dimethylmorpholine-2-carboxamide
CID 124955601
1-piperazin-1-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 82132544
2-[3-(cyclobutadienyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-1-morpholin-4-ylethanone
CID 67162084
(2S)-4-[3-(3-chloro-1,2-oxazol-5-yl)propanoyl]-N,2-dimethylmorpholine-2-carboxamide
CID 125001654
1-[2-(2,3-dihydro-1H-inden-5-yl)acetyl]-4-hydroxypiperidine-4-carboxylic acid
CID 119251957
2-(2,3-dihydro-1H-inden-5-yl)-1-(3-methylpiperidin-1-yl)ethanone
CID 110767307
(2R)-N,2-dimethyl-4-[2-(4-methylpiperidin-1-yl)acetyl]morpholine-2-carboxamide
CID 124998027
1-[(5R)-5-hydroxy-1-oxa-9-azaspiro[5.5]undecan-9-yl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 124959970
4-[2-(4-chloropyrazol-1-yl)acetyl]-N,2-dimethylmorpholine-2-carboxamide
CID 110094868

Frequently Asked Questions

What is the IUPAC name of (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide?
The IUPAC name of (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide (CID 124999466) is (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide.
What is the SMILES notation for (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide?
The canonical SMILES for (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide is CNC(=O)[C@]1(C)CN(C(=O)Cc2ccc3c(c2)CCCC3)CCO1.
What is the InChIKey of (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide?
The InChIKey is RPBNFKOPJOYTKQ-IBGZPJMESA-N. The full InChI is InChI=1S/C19H26N2O3/c1-19(18(23)20-2)13-21(9-10-24-19)17(22)12-14-7-8-15-5-3-4-6-16(15)11-14/h7-8,11H,3-6,9-10,12-13H2,1-2H3,(H,20,23)/t19-/m0/s1.
What are the key properties of (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide?
(2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,2-dimethyl-4-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]morpholine-2-carboxamide is sourced from PubChem (CID 124999466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).