(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone

C16H25N3O2S — CID 96578007

IUPAC(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
SMILESC[C@H](C1CCN(C(=O)c2sccc2N)CC1)N1CCOCC1
InChIInChI=1S/C16H25N3O2S/c1-12(18-7-9-21-10-8-18)13-2-5-19(6-3-13)16(20)15-14(17)4-11-22-15/h4,11-13H,2-3,5-10,17H2,1H3/t12-/m1/s1
InChIKeyRGOHXNDXGXEGOA-GFCCVEGCSA-N
MW323.46 g/mol
LogP1.90
Rot. Bonds3

About (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone

(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone (PubChem CID 96578007) has the molecular formula C16H25N3O2S and a molecular weight of 323.46 g/mol. Its IUPAC name is (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
PubChem CID96578007
Molecular FormulaC16H25N3O2S
Molecular Weight323.46 g/mol
Exact Mass323.17
IUPAC Name(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
SMILESC[C@H](C1CCN(C(=O)c2sccc2N)CC1)N1CCOCC1
InChIInChI=1S/C16H25N3O2S/c1-12(18-7-9-21-10-8-18)13-2-5-19(6-3-13)16(20)15-14(17)4-11-22-15/h4,11-13H,2-3,5-10,17H2,1H3/t12-/m1/s1
InChIKeyRGOHXNDXGXEGOA-GFCCVEGCSA-N
XLogP1.90
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.46
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone with MolForge

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Related Compounds

(3-aminothiophen-2-yl)-(4-methylpiperidin-1-yl)methanone
CID 61091260
N-[1-(3-aminothiophene-2-carbonyl)piperidin-4-yl]-2-methylpropanamide
CID 61109066
(3-aminothiophen-2-yl)-[4-[(dimethylamino)methyl]piperidin-1-yl]methanone
CID 61115182
(3-aminothiophen-2-yl)-[3-(dimethylamino)pyrrolidin-1-yl]methanone
CID 63166059
4-(3-aminothiophene-2-carbonyl)-N,N-diethylpiperazine-1-carboxamide
CID 61109752
[4-(1-aminoethyl)piperidin-1-yl]-(3-bromothiophen-2-yl)methanone;hydrochloride
CID 119519075
(4-chloro-2-hydroxyphenyl)-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 56904274
N-[1-(3-aminothiophene-2-carbonyl)piperidin-4-yl]methanesulfonamide
CID 61105540
(1-ethylindol-5-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone
CID 95896712
4-(3-aminothiophene-2-carbonyl)piperazine-1-sulfonamide
CID 61140085
(3-aminothiophen-2-yl)-[4-(oxolan-2-ylmethyl)piperazin-1-yl]methanone
CID 61115634
(3-aminothiophen-2-yl)-[4-(2-ethoxyethoxy)piperidin-1-yl]methanone
CID 61109278

Frequently Asked Questions

What is the IUPAC name of (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
The IUPAC name of (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone (CID 96578007) is (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone.
What is the SMILES notation for (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
The canonical SMILES for (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone is C[C@H](C1CCN(C(=O)c2sccc2N)CC1)N1CCOCC1.
What is the InChIKey of (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
The InChIKey is RGOHXNDXGXEGOA-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H25N3O2S/c1-12(18-7-9-21-10-8-18)13-2-5-19(6-3-13)16(20)15-14(17)4-11-22-15/h4,11-13H,2-3,5-10,17H2,1H3/t12-/m1/s1.
What are the key properties of (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone?
(3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone has a molecular weight of 323.46 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminothiophen-2-yl)-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methanone is sourced from PubChem (CID 96578007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).