3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide

C14H22N2O2S — CID 81409193

IUPAC3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide
SMILESC[C@H](NC(=O)CCOC1CCNCC1)c1cccs1
InChIInChI=1S/C14H22N2O2S/c1-11(13-3-2-10-19-13)16-14(17)6-9-18-12-4-7-15-8-5-12/h2-3,10-12,15H,4-9H2,1H3,(H,16,17)/t11-/m0/s1
InChIKeyJVUHBUZOZXVNSG-NSHDSACASA-N
MW282.41 g/mol
LogP2.08
Rot. Bonds6

About 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide

3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide (PubChem CID 81409193) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide.

Molecular Properties

Compound Name3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide
PubChem CID81409193
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC Name3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide
SMILESC[C@H](NC(=O)CCOC1CCNCC1)c1cccs1
InChIInChI=1S/C14H22N2O2S/c1-11(13-3-2-10-19-13)16-14(17)6-9-18-12-4-7-15-8-5-12/h2-3,10-12,15H,4-9H2,1H3,(H,16,17)/t11-/m0/s1
InChIKeyJVUHBUZOZXVNSG-NSHDSACASA-N
XLogP2.08
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenoxy-N-(1-thiophen-2-ylethyl)propanamide
CID 110733991
3-(cyclopropylamino)-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 81408603
4-oxo-4-(1-thiophen-2-ylethylamino)butanoic acid
CID 43399724
4-amino-4-methyl-N-[(1S)-1-thiophen-2-ylethyl]pentanamide
CID 81409083
3-piperidin-4-yloxy-N-(2-propan-2-ylphenyl)propanamide
CID 63877511
3-methyl-2-(3-piperidin-4-yloxypropanoylamino)butanamide
CID 103920702
N-(1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide
CID 63006092
(2S)-4-methyl-2-(3-piperidin-4-yloxypropanoylamino)pentanoic acid
CID 78953665
3-(methylamino)-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 81408507
3-(4-fluorophenyl)sulfanyl-N-(1-thiophen-2-ylethyl)propanamide
CID 47098774
N-phenyl-3-piperidin-4-yloxypropanamide
CID 63877329
3-piperidin-4-yloxy-N-(thiophen-3-ylmethyl)propanamide
CID 63905466

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
The IUPAC name of 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide (CID 81409193) is 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide.
What is the SMILES notation for 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
The canonical SMILES for 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide is C[C@H](NC(=O)CCOC1CCNCC1)c1cccs1.
What is the InChIKey of 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
The InChIKey is JVUHBUZOZXVNSG-NSHDSACASA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-11(13-3-2-10-19-13)16-14(17)6-9-18-12-4-7-15-8-5-12/h2-3,10-12,15H,4-9H2,1H3,(H,16,17)/t11-/m0/s1.
What are the key properties of 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide has a molecular weight of 282.41 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yloxy-N-[(1S)-1-thiophen-2-ylethyl]propanamide is sourced from PubChem (CID 81409193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).