N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide

C14H21N3O2 — CID 81108897

IUPACN,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide
SMILESCC(NC1CCCc2[nH]c(=O)ccc21)C(=O)N(C)C
InChIInChI=1S/C14H21N3O2/c1-9(14(19)17(2)3)15-11-5-4-6-12-10(11)7-8-13(18)16-12/h7-9,11,15H,4-6H2,1-3H3,(H,16,18)
InChIKeyHMGLNAZGCHBKHX-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.82
Rot. Bonds3

About N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide

N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide (PubChem CID 81108897) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide
PubChem CID81108897
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide
SMILESCC(NC1CCCc2[nH]c(=O)ccc21)C(=O)N(C)C
InChIInChI=1S/C14H21N3O2/c1-9(14(19)17(2)3)15-11-5-4-6-12-10(11)7-8-13(18)16-12/h7-9,11,15H,4-6H2,1-3H3,(H,16,18)
InChIKeyHMGLNAZGCHBKHX-UHFFFAOYSA-N
XLogP0.82
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide?
The IUPAC name of N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide (CID 81108897) is N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide is CC(NC1CCCc2[nH]c(=O)ccc21)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide?
The InChIKey is HMGLNAZGCHBKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-9(14(19)17(2)3)15-11-5-4-6-12-10(11)7-8-13(18)16-12/h7-9,11,15H,4-6H2,1-3H3,(H,16,18).
What are the key properties of N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide?
N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide has a molecular weight of 263.34 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)amino]propanamide is sourced from PubChem (CID 81108897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).