N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide

C19H25N3O4 — CID 97148392

IUPACN-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide
SMILESCC(=O)NCCOc1ccc(C(=O)N2CC[C@]3(CCCNC3=O)C2)cc1
InChIInChI=1S/C19H25N3O4/c1-14(23)20-10-12-26-16-5-3-15(4-6-16)17(24)22-11-8-19(13-22)7-2-9-21-18(19)25/h3-6H,2,7-13H2,1H3,(H,20,23)(H,21,25)/t19-/m1/s1
InChIKeyZEOADNTZKFHVAL-LJQANCHMSA-N
MW359.43 g/mol
LogP0.94
Rot. Bonds5

About N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide

N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide (PubChem CID 97148392) has the molecular formula C19H25N3O4 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide
PubChem CID97148392
Molecular FormulaC19H25N3O4
Molecular Weight359.43 g/mol
Exact Mass359.18
IUPAC NameN-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide
SMILESCC(=O)NCCOc1ccc(C(=O)N2CC[C@]3(CCCNC3=O)C2)cc1
InChIInChI=1S/C19H25N3O4/c1-14(23)20-10-12-26-16-5-3-15(4-6-16)17(24)22-11-8-19(13-22)7-2-9-21-18(19)25/h3-6H,2,7-13H2,1H3,(H,20,23)(H,21,25)/t19-/m1/s1
InChIKeyZEOADNTZKFHVAL-LJQANCHMSA-N
XLogP0.94
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[4-(3-oxa-9-azaspiro[5.5]undecane-9-carbonyl)phenoxy]ethyl]acetamide
CID 56876543
2-(3-chloro-5-methoxybenzoyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72880026
(5S)-2-(3-chloro-5-methoxybenzoyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97128167
1-(4-ethoxy-3-methylphenyl)-4-(6-oxo-2,7-diazaspiro[4.5]decan-2-yl)butane-1,4-dione
CID 72867011
1-(4-ethoxy-3-methylphenyl)-4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]butane-1,4-dione
CID 97122224
2-(1-ethyl-2,5-dimethylpyrrole-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72896595
(5S)-N-tert-butyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 97125831
methyl 4-(2-acetamidoethoxy)benzoate
CID 3104610
2-(5-methyl-2-phenyl-1H-imidazole-4-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72926019
N-[2-[4-[2-(trifluoromethyl)morpholine-4-carbonyl]phenoxy]ethyl]acetamide
CID 56880091
2-(4-methylpiperazine-1-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72937627
N-[2-[4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]ethyl]acetamide
CID 14969551

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide?
The IUPAC name of N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide (CID 97148392) is N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide.
What is the SMILES notation for N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide?
The canonical SMILES for N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide is CC(=O)NCCOc1ccc(C(=O)N2CC[C@]3(CCCNC3=O)C2)cc1.
What is the InChIKey of N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide?
The InChIKey is ZEOADNTZKFHVAL-LJQANCHMSA-N. The full InChI is InChI=1S/C19H25N3O4/c1-14(23)20-10-12-26-16-5-3-15(4-6-16)17(24)22-11-8-19(13-22)7-2-9-21-18(19)25/h3-6H,2,7-13H2,1H3,(H,20,23)(H,21,25)/t19-/m1/s1.
What are the key properties of N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide?
N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide has a molecular weight of 359.43 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]phenoxy]ethyl]acetamide is sourced from PubChem (CID 97148392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).