2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride

C17H26ClN3O2 — CID 70690960

IUPAC2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride
SMILESCCCN(CCC)CC(=O)Nc1cccc2c1CCC(=O)N2.Cl
InChIInChI=1S/C17H25N3O2.ClH/c1-3-10-20(11-4-2)12-17(22)19-15-7-5-6-14-13(15)8-9-16(21)18-14;/h5-7H,3-4,8-12H2,1-2H3,(H,18,21)(H,19,22);1H
InChIKeyNWSYLTLBOFLLHC-UHFFFAOYSA-N
MW339.87 g/mol
LogP3.05
Rot. Bonds7

About 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride

2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride (PubChem CID 70690960) has the molecular formula C17H26ClN3O2 and a molecular weight of 339.87 g/mol. Its IUPAC name is 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride
PubChem CID70690960
Molecular FormulaC17H26ClN3O2
Molecular Weight339.87 g/mol
Exact Mass339.17
IUPAC Name2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride
SMILESCCCN(CCC)CC(=O)Nc1cccc2c1CCC(=O)N2.Cl
InChIInChI=1S/C17H25N3O2.ClH/c1-3-10-20(11-4-2)12-17(22)19-15-7-5-6-14-13(15)8-9-16(21)18-14;/h5-7H,3-4,8-12H2,1-2H3,(H,18,21)(H,19,22);1H
InChIKeyNWSYLTLBOFLLHC-UHFFFAOYSA-N
XLogP3.05
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.87
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(9,10-dioxoanthracen-1-yl)-2-(dipropylamino)acetamide
CID 34599401
N-[3-[[2-(dipropylamino)acetyl]amino]-2-methylphenyl]propanamide
CID 54818982
2-(dipropylamino)-N-(2-ethylphenyl)acetamide
CID 109006597
2-[[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 8810136
2-(dibutylamino)-N-(2-methylphenyl)acetamide;hydrochloride
CID 3026049
2-[2-hydroxyethyl(propyl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 60692713
2-(dipropylamino)-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 54818625
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-phenylacetamide
CID 9038815
2-[[2-(2-fluoroanilino)-2-oxoethyl]-propylamino]acetic acid
CID 61008384
5-(hydroxymethyl)-3,4-dihydro-1H-quinolin-2-one
CID 84655921
methyl 4-[2-(2-oxo-1,3-dihydroindol-4-yl)ethyl-propylamino]butanoate
CID 10757921
4-[2-(2-oxo-1,3-dihydroindol-4-yl)ethyl-propylamino]butanoic acid
CID 11449569

Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride?
The IUPAC name of 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride (CID 70690960) is 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride is CCCN(CCC)CC(=O)Nc1cccc2c1CCC(=O)N2.Cl.
What is the InChIKey of 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride?
The InChIKey is NWSYLTLBOFLLHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2.ClH/c1-3-10-20(11-4-2)12-17(22)19-15-7-5-6-14-13(15)8-9-16(21)18-14;/h5-7H,3-4,8-12H2,1-2H3,(H,18,21)(H,19,22);1H.
What are the key properties of 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride?
2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride has a molecular weight of 339.87 g/mol, XLogP of 3.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-N-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)acetamide;hydrochloride is sourced from PubChem (CID 70690960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).