N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

C12H16N2O — CID 21393481

IUPACN-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)C(N)CCC2
InChIInChI=1S/C12H16N2O/c1-8(15)14-10-6-5-9-3-2-4-12(13)11(9)7-10/h5-7,12H,2-4,13H2,1H3,(H,14,15)
InChIKeyUONCLIZDDAHWGU-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.98
Rot. Bonds1

About N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide (PubChem CID 21393481) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide.

Molecular Properties

Compound NameN-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
PubChem CID21393481
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC NameN-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)C(N)CCC2
InChIInChI=1S/C12H16N2O/c1-8(15)14-10-6-5-9-3-2-4-12(13)11(9)7-10/h5-7,12H,2-4,13H2,1H3,(H,14,15)
InChIKeyUONCLIZDDAHWGU-UHFFFAOYSA-N
XLogP1.98
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-amino-2,3-dihydro-1H-inden-5-yl]acetamide
CID 55277889
(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)carbamic acid
CID 135386697
N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide
CID 67960562
1-[(5S)-5-amino-5,6,7,8-tetrahydronaphthalen-2-yl]ethanone
CID 130615296
1-(3-amino-2,3-dihydro-1H-inden-5-yl)ethanone
CID 90845496
1,2,3,4-tetrahydronaphthalene-1,7-diamine
CID 21256693
(1R)-1,2,3,4-tetrahydronaphthalene-1,7-diamine
CID 55277801
6-N-methyl-1,2,3,4-tetrahydronaphthalene-1,6-diamine
CID 83816639
(1S)-7-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 21104537
4-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)benzoic acid
CID 82541831
N-[7-(aminomethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl]acetamide
CID 123877752
5-amino-N-pyridin-4-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 11323111

Frequently Asked Questions

What is the IUPAC name of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
The IUPAC name of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide (CID 21393481) is N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide.
What is the SMILES notation for N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
The canonical SMILES for N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide is CC(=O)Nc1ccc2c(c1)C(N)CCC2.
What is the InChIKey of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
The InChIKey is UONCLIZDDAHWGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-8(15)14-10-6-5-9-3-2-4-12(13)11(9)7-10/h5-7,12H,2-4,13H2,1H3,(H,14,15).
What are the key properties of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide has a molecular weight of 204.27 g/mol, XLogP of 1.98, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide is sourced from PubChem (CID 21393481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).