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

C14H19NO — CID 652088

IUPACN-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
SMILESCCCC(=O)Nc1cccc2c1CCCC2
InChIInChI=1S/C14H19NO/c1-2-6-14(16)15-13-10-5-8-11-7-3-4-9-12(11)13/h5,8,10H,2-4,6-7,9H2,1H3,(H,15,16)
InChIKeyPEHCVQFCZRTAQG-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.30
Rot. Bonds3

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

N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide (PubChem CID 652088) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide.

Molecular Properties

Compound NameN-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
PubChem CID652088
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
SMILESCCCC(=O)Nc1cccc2c1CCCC2
InChIInChI=1S/C14H19NO/c1-2-6-14(16)15-13-10-5-8-11-7-3-4-9-12(11)13/h5,8,10H,2-4,6-7,9H2,1H3,(H,15,16)
InChIKeyPEHCVQFCZRTAQG-UHFFFAOYSA-N
XLogP3.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-oxo-5-(5,6,7,8-tetrahydronaphthalen-1-ylamino)pentanoic acid
CID 17435174
S-[3-oxo-3-(5,6,7,8-tetrahydronaphthalen-1-ylamino)propyl] ethanethioate
CID 88670492
2-amino-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 24708933
3-(methanesulfonamido)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 47175572
2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 17386781
3-(2-oxo-3-propylbenzimidazol-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 18285888
ethane;N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 178170556
2-(4-hydroxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 78838548
N-(2-methyl-1,3-dihydroisoindol-4-yl)butanamide
CID 110478696
3-benzylsulfanyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 8797217
3-(3-methyl-2-oxobenzimidazol-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 16591562
5-(propan-2-ylsulfonylamino)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)pentanamide
CID 20629238

Frequently Asked Questions

What is the IUPAC name of N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
The IUPAC name of N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide (CID 652088) is N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide.
What is the SMILES notation for N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
The canonical SMILES for N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide is CCCC(=O)Nc1cccc2c1CCCC2.
What is the InChIKey of N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
The InChIKey is PEHCVQFCZRTAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-6-14(16)15-13-10-5-8-11-7-3-4-9-12(11)13/h5,8,10H,2-4,6-7,9H2,1H3,(H,15,16).
What are the key properties of N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide?
N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide has a molecular weight of 217.31 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide is sourced from PubChem (CID 652088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).