N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide

C16H23N3O2 — CID 169490460

IUPACN-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC3(CCNC3)CC2)cc1
InChIInChI=1S/C16H23N3O2/c1-21-14-4-2-13(3-5-14)18-15(20)19-10-7-16(8-11-19)6-9-17-12-16/h2-5,17H,6-12H2,1H3,(H,18,20)
InChIKeyHZPUVROQDWXSPK-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.30
Rot. Bonds2

About N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide

N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 169490460) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID169490460
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC3(CCNC3)CC2)cc1
InChIInChI=1S/C16H23N3O2/c1-21-14-4-2-13(3-5-14)18-15(20)19-10-7-16(8-11-19)6-9-17-12-16/h2-5,17H,6-12H2,1H3,(H,18,20)
InChIKeyHZPUVROQDWXSPK-UHFFFAOYSA-N
XLogP2.30
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide;hydrochloride
CID 169490459
N-(3-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide;hydrochloride
CID 169490453
N-(4-methoxyphenyl)-2,7-diazaspiro[3.5]nonane-2-carboxamide
CID 3235204
N-(4-methoxyphenyl)-1,6-diazacycloundecane-1-carboxamide
CID 144843106
N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
CID 16771863
3-amino-1-[(4-methoxyphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 107323777
9-(furan-2-carbonyl)-N-(4-methoxyphenyl)-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 3234137
3-hydroxy-N-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 84727286
tert-butyl formate;N-(4-methoxyphenyl)piperazine-1-carboxamide
CID 174768397
3-ethyl-N-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 63140483
6,7-difluoro-N-(4-methoxyphenyl)-4-oxospiro[1,3-dihydroquinazoline-2,4'-piperidine]-1'-carboxamide
CID 42875577
1-N-(4-methoxyphenyl)-4-N-methyl-1,4-diazepane-1,4-dicarboxamide
CID 23800038

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (CID 169490460) is N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is COc1ccc(NC(=O)N2CCC3(CCNC3)CC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is HZPUVROQDWXSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-21-14-4-2-13(3-5-14)18-15(20)19-10-7-16(8-11-19)6-9-17-12-16/h2-5,17H,6-12H2,1H3,(H,18,20).
What are the key properties of N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 169490460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).