N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide

C19H26N2O2 — CID 134075741

IUPACN-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCC2(CCC(C)c3ccccc32)CC1
InChIInChI=1S/C19H26N2O2/c1-14-7-8-19(17-6-4-3-5-16(14)17)9-11-21(12-10-19)18(23)13-20-15(2)22/h3-6,14H,7-13H2,1-2H3,(H,20,22)
InChIKeyNISVNDAEYBYCRE-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.58
Rot. Bonds2

About N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide

N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide (PubChem CID 134075741) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide
PubChem CID134075741
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCC2(CCC(C)c3ccccc32)CC1
InChIInChI=1S/C19H26N2O2/c1-14-7-8-19(17-6-4-3-5-16(14)17)9-11-21(12-10-19)18(23)13-20-15(2)22/h3-6,14H,7-13H2,1-2H3,(H,20,22)
InChIKeyNISVNDAEYBYCRE-UHFFFAOYSA-N
XLogP2.58
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-1'-methylsulfonylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
CID 134073260
1-(1-pyrrolidin-1-ylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)propan-1-one
CID 118742603
N-[(1S)-1'-(cyclopropylmethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-yl]acetamide
CID 59433199
2-(1-hydroxycyclobutyl)-1-(1-methoxyspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)ethanone
CID 131697083
ethyl 4-[(1S)-1-acetamidospiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl]piperidine-1-carboxylate
CID 59433488
N-[2-[2-(cyclobutylmethyl)-1-oxo-2,9-diazaspiro[5.5]undecan-9-yl]-2-oxoethyl]acetamide
CID 98897256
N-[(1S)-1'-(3,3-dimethyl-2-oxobutyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1-yl]acetamide
CID 24875546
2-[(1S)-1'-acetylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-N-propan-2-ylacetamide
CID 97400614
N-[2-(azetidin-1-yl)-2-oxoethyl]acetamide
CID 121325487
N-[2-[4-(4-hydroxyphenyl)piperidin-1-yl]-2-oxoethyl]acetamide
CID 60712509
1-(dimethylamino)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-carboxamide
CID 131656953
N-[1'-[2-(4-methoxyphenyl)acetyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 134789216

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide?
The IUPAC name of N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide (CID 134075741) is N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide.
What is the SMILES notation for N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide?
The canonical SMILES for N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCC2(CCC(C)c3ccccc32)CC1.
What is the InChIKey of N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide?
The InChIKey is NISVNDAEYBYCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-14-7-8-19(17-6-4-3-5-16(14)17)9-11-21(12-10-19)18(23)13-20-15(2)22/h3-6,14H,7-13H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide?
N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide has a molecular weight of 314.43 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-2-oxoethyl]acetamide is sourced from PubChem (CID 134075741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).