2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide

C15H17N7O3 — CID 118790013

IUPAC2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
SMILESO=C1NCC2(CCN(C(=O)Nc3cccc(-n4cnnn4)c3)CC2)O1
InChIInChI=1S/C15H17N7O3/c23-13(21-6-4-15(5-7-21)9-16-14(24)25-15)18-11-2-1-3-12(8-11)22-10-17-19-20-22/h1-3,8,10H,4-7,9H2,(H,16,24)(H,18,23)
InChIKeyMPHXWUWOUXTGGF-UHFFFAOYSA-N
MW343.35 g/mol
LogP0.77
Rot. Bonds2

About 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide

2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 118790013) has the molecular formula C15H17N7O3 and a molecular weight of 343.35 g/mol. Its IUPAC name is 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID118790013
Molecular FormulaC15H17N7O3
Molecular Weight343.35 g/mol
Exact Mass343.14
IUPAC Name2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
SMILESO=C1NCC2(CCN(C(=O)Nc3cccc(-n4cnnn4)c3)CC2)O1
InChIInChI=1S/C15H17N7O3/c23-13(21-6-4-15(5-7-21)9-16-14(24)25-15)18-11-2-1-3-12(8-11)22-10-17-19-20-22/h1-3,8,10H,4-7,9H2,(H,16,24)(H,18,23)
InChIKeyMPHXWUWOUXTGGF-UHFFFAOYSA-N
XLogP0.77
TPSA114.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.35
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-3-N-ethyl-1-N-[3-(tetrazol-1-yl)phenyl]pyrrolidine-1,3-dicarboxamide
CID 125166963
4-(methoxymethyl)-N-[3-(tetrazol-1-yl)phenyl]piperidine-4-carboxamide
CID 120617842
N-[3-(tetrazol-1-yl)phenyl]piperidine-4-carboxamide
CID 43702817
2-bromo-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 63681198
(5S)-N-(1-benzofuran-5-yl)-2-oxo-1-oxa-3,9-diazaspiro[4.6]undecane-9-carboxamide
CID 95708650
3-methyl-N-[3-(tetrazol-1-yl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119943848
3-chloro-2,2-dimethyl-N-[3-(tetrazol-1-yl)phenyl]propanamide
CID 63679217
2-ethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide
CID 47097708
N-(3-pyrazol-1-ylphenyl)-3-(tetrazol-1-yl)benzamide
CID 55700294
(5S)-N-[[1-(3-methylphenyl)pyrazol-4-yl]methyl]-2-oxo-1-oxa-3,9-diazaspiro[4.6]undecane-9-carboxamide
CID 126426435
2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 118778157
(3S)-3-methyl-1-oxo-N-[3-(tetrazol-1-yl)phenyl]-4H-isochromene-3-carboxamide
CID 7710891

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide (CID 118790013) is 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide is O=C1NCC2(CCN(C(=O)Nc3cccc(-n4cnnn4)c3)CC2)O1.
What is the InChIKey of 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is MPHXWUWOUXTGGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N7O3/c23-13(21-6-4-15(5-7-21)9-16-14(24)25-15)18-11-2-1-3-12(8-11)22-10-17-19-20-22/h1-3,8,10H,4-7,9H2,(H,16,24)(H,18,23).
What are the key properties of 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 343.35 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 118790013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).