2-(3,4-dihydro-2H-quinolin-1-yl)butanamide

C13H18N2O — CID 62901418

IUPAC2-(3,4-dihydro-2H-quinolin-1-yl)butanamide
SMILESCCC(C(N)=O)N1CCCc2ccccc21
InChIInChI=1S/C13H18N2O/c1-2-11(13(14)16)15-9-5-7-10-6-3-4-8-12(10)15/h3-4,6,8,11H,2,5,7,9H2,1H3,(H2,14,16)
InChIKeyNJTTWPSXAZYNRM-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.70
Rot. Bonds3

About 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide

2-(3,4-dihydro-2H-quinolin-1-yl)butanamide (PubChem CID 62901418) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide.

Molecular Properties

Compound Name2-(3,4-dihydro-2H-quinolin-1-yl)butanamide
PubChem CID62901418
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-(3,4-dihydro-2H-quinolin-1-yl)butanamide
SMILESCCC(C(N)=O)N1CCCc2ccccc21
InChIInChI=1S/C13H18N2O/c1-2-11(13(14)16)15-9-5-7-10-6-3-4-8-12(10)15/h3-4,6,8,11H,2,5,7,9H2,1H3,(H2,14,16)
InChIKeyNJTTWPSXAZYNRM-UHFFFAOYSA-N
XLogP1.70
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(5Z)-5-hydroxyimino-3,4-dihydro-2H-1-benzazepin-1-yl]butanamide
CID 114337268
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)butanamide
CID 16576209
2,4-bis(3,4-dihydro-2H-quinolin-1-yl)pentan-3-one
CID 151944573
(2R)-2-(3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 42223767
2-(3,4-dihydro-2H-quinolin-1-yl)propanoyl chloride
CID 12730427
2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanoic acid
CID 43808966
2-(2-oxopyrrolidin-1-yl)butanamide;propane
CID 154648377
4-amino-3-(3,4-dihydro-2H-quinolin-1-yl)-N-methylbutanamide
CID 66427347
benzyl 2-(3,4-dihydro-2H-quinolin-1-yl)propanoate
CID 139697216
ethyl 2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanoate
CID 64661866
2-(3,4-dihydro-2H-quinolin-1-yl)-3-methylbutanoyl chloride
CID 82041996
2-(3,4-dihydro-2H-quinolin-1-yl)-N-ethylbutan-1-amine
CID 62425422

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide?
The IUPAC name of 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide (CID 62901418) is 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide.
What is the SMILES notation for 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide?
The canonical SMILES for 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide is CCC(C(N)=O)N1CCCc2ccccc21.
What is the InChIKey of 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide?
The InChIKey is NJTTWPSXAZYNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-2-11(13(14)16)15-9-5-7-10-6-3-4-8-12(10)15/h3-4,6,8,11H,2,5,7,9H2,1H3,(H2,14,16).
What are the key properties of 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide?
2-(3,4-dihydro-2H-quinolin-1-yl)butanamide has a molecular weight of 218.30 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-2H-quinolin-1-yl)butanamide is sourced from PubChem (CID 62901418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).