(7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide

C20H25N3O2 — CID 124813793

IUPAC(7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
SMILESCNC(=O)[C@H]1COC2(CN(Cc3cccc4ccccc34)C2)CN1C
InChIInChI=1S/C20H25N3O2/c1-21-19(24)18-11-25-20(12-22(18)2)13-23(14-20)10-16-8-5-7-15-6-3-4-9-17(15)16/h3-9,18H,10-14H2,1-2H3,(H,21,24)/t18-/m1/s1
InChIKeyQWNHYDKYWNLTOE-GOSISDBHSA-N
MW339.44 g/mol
LogP1.47
Rot. Bonds3

About (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide

(7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide (PubChem CID 124813793) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide.

Molecular Properties

Compound Name(7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
PubChem CID124813793
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name(7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
SMILESCNC(=O)[C@H]1COC2(CN(Cc3cccc4ccccc34)C2)CN1C
InChIInChI=1S/C20H25N3O2/c1-21-19(24)18-11-25-20(12-22(18)2)13-23(14-20)10-16-8-5-7-15-6-3-4-9-17(15)16/h3-9,18H,10-14H2,1-2H3,(H,21,24)/t18-/m1/s1
InChIKeyQWNHYDKYWNLTOE-GOSISDBHSA-N
XLogP1.47
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide with MolForge

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Related Compounds

2-[(2-methoxyphenyl)methyl]-N,8-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 131658445
8-(cyclopropylmethyl)-2-(1H-indol-4-ylmethyl)-N-methyl-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 131660879
N,8-dimethyl-2-[(4-methylsulfonylphenyl)methyl]-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide;2,2,2-trifluoroacetic acid
CID 171693377
(7R)-N,8-dimethyl-2-(2-thiophen-3-ylacetyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 124813777
8-(cyclopropylmethyl)-N-methyl-2-(pyridin-2-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 131678398
N,8-dimethyl-2-(2-methylfuran-3-carbonyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 131651832
N-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]benzamide
CID 2802697
(7R)-2-(5-chloro-1-benzofuran-2-carbonyl)-N,8-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 124814985
2-(5-chloro-1-benzofuran-2-carbonyl)-N,8-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide
CID 131658487
2,2-dimethyl-4-(naphthalen-1-ylmethyl)morpholine
CID 55649204
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
1-(naphthalen-1-ylmethyl)-N-propan-2-ylpiperidine-4-carboxamide
CID 60609439

Frequently Asked Questions

What is the IUPAC name of (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide?
The IUPAC name of (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide (CID 124813793) is (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide.
What is the SMILES notation for (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide?
The canonical SMILES for (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide is CNC(=O)[C@H]1COC2(CN(Cc3cccc4ccccc34)C2)CN1C.
What is the InChIKey of (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide?
The InChIKey is QWNHYDKYWNLTOE-GOSISDBHSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-21-19(24)18-11-25-20(12-22(18)2)13-23(14-20)10-16-8-5-7-15-6-3-4-9-17(15)16/h3-9,18H,10-14H2,1-2H3,(H,21,24)/t18-/m1/s1.
What are the key properties of (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide?
(7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-N,8-dimethyl-2-(naphthalen-1-ylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane-7-carboxamide is sourced from PubChem (CID 124813793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).