N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide

C19H28N2O2S — CID 154865751

IUPACN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide
SMILESO=C(NCC(c1cccs1)N1CCOCC1)C1CCCC2(CC2)C1
InChIInChI=1S/C19H28N2O2S/c22-18(15-3-1-5-19(13-15)6-7-19)20-14-16(17-4-2-12-24-17)21-8-10-23-11-9-21/h2,4,12,15-16H,1,3,5-11,13-14H2,(H,20,22)
InChIKeyPHDFTAOOVNVBEU-UHFFFAOYSA-N
MW348.51 g/mol
LogP3.21
Rot. Bonds5

About N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide (PubChem CID 154865751) has the molecular formula C19H28N2O2S and a molecular weight of 348.51 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide
PubChem CID154865751
Molecular FormulaC19H28N2O2S
Molecular Weight348.51 g/mol
Exact Mass348.19
IUPAC NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide
SMILESO=C(NCC(c1cccs1)N1CCOCC1)C1CCCC2(CC2)C1
InChIInChI=1S/C19H28N2O2S/c22-18(15-3-1-5-19(13-15)6-7-19)20-14-16(17-4-2-12-24-17)21-8-10-23-11-9-21/h2,4,12,15-16H,1,3,5-11,13-14H2,(H,20,22)
InChIKeyPHDFTAOOVNVBEU-UHFFFAOYSA-N
XLogP3.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.51
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide
CID 119829137
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CID 30468496
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyrrolidine-1-carboxamide
CID 94494130
1-amino-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclopropane-1-carboxamide
CID 65464082
(2S,4S)-2-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-4-carboxamide
CID 120631423
(1R)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 39982815
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N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]oxolane-2-carboxamide
CID 112504779
2-amino-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(oxan-4-yl)acetamide
CID 120796894
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]prop-2-enamide
CID 7713761
1-(furan-3-ylmethyl)-3-(2-morpholin-4-yl-2-thiophen-2-ylethyl)urea
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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide (CID 154865751) is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide is O=C(NCC(c1cccs1)N1CCOCC1)C1CCCC2(CC2)C1.
What is the InChIKey of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide?
The InChIKey is PHDFTAOOVNVBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2S/c22-18(15-3-1-5-19(13-15)6-7-19)20-14-16(17-4-2-12-24-17)21-8-10-23-11-9-21/h2,4,12,15-16H,1,3,5-11,13-14H2,(H,20,22).
What are the key properties of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide?
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide has a molecular weight of 348.51 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide is sourced from PubChem (CID 154865751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).