N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide

C16H22N2O — CID 19696246

IUPACN-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
SMILESCC(=O)Nc1cccc2c1CC(N1CCCC1)CC2
InChIInChI=1S/C16H22N2O/c1-12(19)17-16-6-4-5-13-7-8-14(11-15(13)16)18-9-2-3-10-18/h4-6,14H,2-3,7-11H2,1H3,(H,17,19)
InChIKeyUPKYYHSFLITFQA-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.60
Rot. Bonds2

About N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide

N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 19696246) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
PubChem CID19696246
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
SMILESCC(=O)Nc1cccc2c1CC(N1CCCC1)CC2
InChIInChI=1S/C16H22N2O/c1-12(19)17-16-6-4-5-13-7-8-14(11-15(13)16)18-9-2-3-10-18/h4-6,14H,2-3,7-11H2,1H3,(H,17,19)
InChIKeyUPKYYHSFLITFQA-UHFFFAOYSA-N
XLogP2.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 19696208
N-(7-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 19696265
ethane;N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 178170556
methyl 1-(8-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)azetidine-3-carboxylate
CID 135389934
N-[7-(benzylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
CID 19696146
N-[7-[benzyl(methyl)amino]-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
CID 54535301
N-[(6R)-6-amino-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride
CID 18650731
N-[6-(dimethylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
CID 14836484
1-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-1,4-diazepane
CID 15137215
[(7S)-7-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl]urea
CID 68749271
N-(2-acetyl-3,4-dihydro-1H-isoquinolin-5-yl)acetamide
CID 10082667
(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol
CID 59144793

Frequently Asked Questions

What is the IUPAC name of N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide (CID 19696246) is N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide is CC(=O)Nc1cccc2c1CC(N1CCCC1)CC2.
What is the InChIKey of N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is UPKYYHSFLITFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-12(19)17-16-6-4-5-13-7-8-14(11-15(13)16)18-9-2-3-10-18/h4-6,14H,2-3,7-11H2,1H3,(H,17,19).
What are the key properties of N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide?
N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 258.36 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 19696246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).