2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide

C18H26N2O3 — CID 135110631

IUPAC2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCC[C@@]2(CCC[C@H]2O)C1
InChIInChI=1S/C18H26N2O3/c1-23-15-7-3-2-6-14(15)19-17(22)12-20-11-5-10-18(13-20)9-4-8-16(18)21/h2-3,6-7,16,21H,4-5,8-13H2,1H3,(H,19,22)/t16-,18+/m1/s1
InChIKeyNQBLIBSPTLPJJS-AEFFLSMTSA-N
MW318.42 g/mol
LogP2.26
Rot. Bonds4

About 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide

2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide (PubChem CID 135110631) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide
PubChem CID135110631
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCC[C@@]2(CCC[C@H]2O)C1
InChIInChI=1S/C18H26N2O3/c1-23-15-7-3-2-6-14(15)19-17(22)12-20-11-5-10-18(13-20)9-4-8-16(18)21/h2-3,6-7,16,21H,4-5,8-13H2,1H3,(H,19,22)/t16-,18+/m1/s1
InChIKeyNQBLIBSPTLPJJS-AEFFLSMTSA-N
XLogP2.26
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide with MolForge

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Related Compounds

2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 31478295
N-[(3,4-dimethoxyphenyl)methyl]-2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]acetamide
CID 135107673
N-(2-methoxyphenyl)-2-[(3S)-3-methoxypiperidin-1-yl]acetamide
CID 124505947
N-(2-methoxyphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919921
2-[3-(aminomethyl)piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 43186953
2-[3-(aminomethyl)piperidin-1-yl]-N-(2-methoxyphenyl)acetamide;hydrochloride
CID 119915836
N-(2-methoxyphenyl)-2-[3-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 166601980
N-(2-methoxyphenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922615
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-(2-methoxyphenyl)acetamide
CID 22194042
1-[2-(2-methoxyanilino)-2-oxoethyl]-N-phenylpiperidine-3-carboxamide
CID 86913235
N-(2-ethylphenyl)-2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 9436558
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 8930541

Frequently Asked Questions

What is the IUPAC name of 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide (CID 135110631) is 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN1CCC[C@@]2(CCC[C@H]2O)C1.
What is the InChIKey of 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide?
The InChIKey is NQBLIBSPTLPJJS-AEFFLSMTSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-23-15-7-3-2-6-14(15)19-17(22)12-20-11-5-10-18(13-20)9-4-8-16(18)21/h2-3,6-7,16,21H,4-5,8-13H2,1H3,(H,19,22)/t16-,18+/m1/s1.
What are the key properties of 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide?
2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 135110631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).