3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide

C17H19N3O — CID 81485558

IUPAC3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
SMILESO=C(CCc1ccccn1)Nc1ccc2c(c1)CCCN2
InChIInChI=1S/C17H19N3O/c21-17(9-7-14-5-1-2-10-18-14)20-15-6-8-16-13(12-15)4-3-11-19-16/h1-2,5-6,8,10,12,19H,3-4,7,9,11H2,(H,20,21)
InChIKeyHUQIPLZCYHUPFB-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.01
Rot. Bonds4

About 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide

3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide (PubChem CID 81485558) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide.

Molecular Properties

Compound Name3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
PubChem CID81485558
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
SMILESO=C(CCc1ccccn1)Nc1ccc2c(c1)CCCN2
InChIInChI=1S/C17H19N3O/c21-17(9-7-14-5-1-2-10-18-14)20-15-6-8-16-13(12-15)4-3-11-19-16/h1-2,5-6,8,10,12,19H,3-4,7,9,11H2,(H,20,21)
InChIKeyHUQIPLZCYHUPFB-UHFFFAOYSA-N
XLogP3.01
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopentyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
CID 62632415
2-pyrazol-1-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
CID 63282524
N-(4-hydroxyphenyl)-3-pyridin-2-ylpropanamide
CID 80743821
2-fluoro-4-(3-pyridin-2-ylpropanoylamino)benzoic acid
CID 107526552
N-(3-amino-4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 81466595
N-(3-bromo-4-methylphenyl)-3-pyridin-2-ylpropanamide
CID 110389230
N-(2,3-dihydro-1H-indol-5-yl)butanamide
CID 63253204
3-bromo-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-2-carboxamide
CID 107519997
2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
CID 122080484
N-(2,3-dihydro-1H-indol-5-yl)-2-phenylacetamide
CID 63252775
1-(2,3-dihydro-1H-inden-5-yl)-3-(2-pyridin-2-ylethyl)urea
CID 47032533
N-(1,2,3,4-tetrahydroquinolin-6-yl)thiadiazole-4-carboxamide;hydrochloride
CID 119547224

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide?
The IUPAC name of 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide (CID 81485558) is 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide.
What is the SMILES notation for 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide?
The canonical SMILES for 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide is O=C(CCc1ccccn1)Nc1ccc2c(c1)CCCN2.
What is the InChIKey of 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide?
The InChIKey is HUQIPLZCYHUPFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c21-17(9-7-14-5-1-2-10-18-14)20-15-6-8-16-13(12-15)4-3-11-19-16/h1-2,5-6,8,10,12,19H,3-4,7,9,11H2,(H,20,21).
What are the key properties of 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide?
3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide has a molecular weight of 281.36 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide is sourced from PubChem (CID 81485558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).