4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide

C23H29NO2 — CID 133191484

IUPAC4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide
SMILESCCC(NC(=O)c1ccc(OC(C)C)cc1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C23H29NO2/c1-4-22(20-10-9-17-7-5-6-8-19(17)15-20)24-23(25)18-11-13-21(14-12-18)26-16(2)3/h9-16,22H,4-8H2,1-3H3,(H,24,25)
InChIKeyGZCSQDOZPRUIFF-UHFFFAOYSA-N
MW351.49 g/mol
LogP5.23
Rot. Bonds6

About 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide

4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide (PubChem CID 133191484) has the molecular formula C23H29NO2 and a molecular weight of 351.49 g/mol. Its IUPAC name is 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide.

Molecular Properties

Compound Name4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide
PubChem CID133191484
Molecular FormulaC23H29NO2
Molecular Weight351.49 g/mol
Exact Mass351.22
IUPAC Name4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide
SMILESCCC(NC(=O)c1ccc(OC(C)C)cc1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C23H29NO2/c1-4-22(20-10-9-17-7-5-6-8-19(17)15-20)24-23(25)18-11-13-21(14-12-18)26-16(2)3/h9-16,22H,4-8H2,1-3H3,(H,24,25)
InChIKeyGZCSQDOZPRUIFF-UHFFFAOYSA-N
XLogP5.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.49
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-(4-methoxyphenyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100704372
N-[2-oxo-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl]-4-propan-2-yloxybenzamide
CID 24549297
N-[1-(3,4-dimethoxyphenyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 133231412
N-[(1S)-1-phenylpropyl]-4-propan-2-yloxybenzamide
CID 28632520
1-[1-(4-hydroxyphenoxy)ethyl]-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]urea
CID 108870999
N-[(1R)-1-(3,4-dimethylphenyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100705656
4-[methyl(methylsulfonyl)amino]-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide
CID 133191284
N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]propanamide
CID 127117899
2-(3,5-dimethylphenoxy)-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]propanamide
CID 133191614
3-methyl-4-nitro-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide
CID 99779959
2-oxo-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]-1,3-dihydroindole-5-carboxamide
CID 108784618
N-[(4-propan-2-yloxyphenyl)methyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100704146

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide?
The IUPAC name of 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide (CID 133191484) is 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide.
What is the SMILES notation for 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide?
The canonical SMILES for 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide is CCC(NC(=O)c1ccc(OC(C)C)cc1)c1ccc2c(c1)CCCC2.
What is the InChIKey of 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide?
The InChIKey is GZCSQDOZPRUIFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO2/c1-4-22(20-10-9-17-7-5-6-8-19(17)15-20)24-23(25)18-11-13-21(14-12-18)26-16(2)3/h9-16,22H,4-8H2,1-3H3,(H,24,25).
What are the key properties of 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide?
4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide has a molecular weight of 351.49 g/mol, XLogP of 5.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yloxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]benzamide is sourced from PubChem (CID 133191484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).