N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide

C23H29N3O3S — CID 9150147

IUPACN-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(N[C@H](CN1CCOCC1)c1ccccc1)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C23H29N3O3S/c27-22(19-8-10-26(11-9-19)23(28)21-7-4-16-30-21)24-20(18-5-2-1-3-6-18)17-25-12-14-29-15-13-25/h1-7,16,19-20H,8-15,17H2,(H,24,27)/t20-/m1/s1
InChIKeyUSWYXXFJQCTYPQ-HXUWFJFHSA-N
MW427.57 g/mol
LogP2.79
Rot. Bonds6

About N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide

N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide (PubChem CID 9150147) has the molecular formula C23H29N3O3S and a molecular weight of 427.57 g/mol. Its IUPAC name is N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
PubChem CID9150147
Molecular FormulaC23H29N3O3S
Molecular Weight427.57 g/mol
Exact Mass427.19
IUPAC NameN-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(N[C@H](CN1CCOCC1)c1ccccc1)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C23H29N3O3S/c27-22(19-8-10-26(11-9-19)23(28)21-7-4-16-30-21)24-20(18-5-2-1-3-6-18)17-25-12-14-29-15-13-25/h1-7,16,19-20H,8-15,17H2,(H,24,27)/t20-/m1/s1
InChIKeyUSWYXXFJQCTYPQ-HXUWFJFHSA-N
XLogP2.79
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.57
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 9150146
N-(3-methyl-1-phenylbutyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 51199351
dimethyl-[(2S)-2-phenyl-2-[[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]amino]ethyl]azanium
CID 8938106
4-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 31370513
N-[3-[(3aS)-5-(thiophene-2-carbonyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-phenylpropyl]oxolane-3-carboxamide
CID 90698648
N-[(2-hydroxynaphthalen-1-yl)-phenylmethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 134061219
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 1075464
1-(thiophene-2-carbonyl)piperidine-4-carboxylic acid
CID 760311
N-[(4-chlorophenyl)-thiophen-2-ylmethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 55751666
N-[1-(thiophene-2-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
CID 46446282
N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 51306894

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide (CID 9150147) is N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide is O=C(N[C@H](CN1CCOCC1)c1ccccc1)C1CCN(C(=O)c2cccs2)CC1.
What is the InChIKey of N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is USWYXXFJQCTYPQ-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H29N3O3S/c27-22(19-8-10-26(11-9-19)23(28)21-7-4-16-30-21)24-20(18-5-2-1-3-6-18)17-25-12-14-29-15-13-25/h1-7,16,19-20H,8-15,17H2,(H,24,27)/t20-/m1/s1.
What are the key properties of N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 427.57 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 9150147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).