7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one

C17H22N2O2 — CID 170870829

IUPAC7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
SMILESCc1ccc2cc(CCCN3CCOCC3)c(=O)[nH]c2c1
InChIInChI=1S/C17H22N2O2/c1-13-4-5-14-12-15(17(20)18-16(14)11-13)3-2-6-19-7-9-21-10-8-19/h4-5,11-12H,2-3,6-10H2,1H3,(H,18,20)
InChIKeyBUJDXWLLHFATKF-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.10
Rot. Bonds4

About 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one

7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one (PubChem CID 170870829) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one.

Molecular Properties

Compound Name7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
PubChem CID170870829
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
SMILESCc1ccc2cc(CCCN3CCOCC3)c(=O)[nH]c2c1
InChIInChI=1S/C17H22N2O2/c1-13-4-5-14-12-15(17(20)18-16(14)11-13)3-2-6-19-7-9-21-10-8-19/h4-5,11-12H,2-3,6-10H2,1H3,(H,18,20)
InChIKeyBUJDXWLLHFATKF-UHFFFAOYSA-N
XLogP2.10
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]-1H-quinolin-2-one
CID 170864276
6-ethoxy-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
CID 170870835
6-methyl-3-[(3-morpholin-4-ylpropylamino)methyl]-1H-quinolin-2-one
CID 3169163
1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)-1-(2-morpholin-4-ylethyl)thiourea
CID 3169728
7-methyl-3-[3-oxo-3-(4-propylpiperazin-1-yl)propyl]-1H-quinolin-2-one
CID 53174829
3-[[(6S)-6-[(dimethylamino)methyl]-1,4-oxazepan-4-yl]methyl]-7-methyl-1H-quinolin-2-one
CID 95221791
3-(4-methoxyphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)thiourea
CID 3169729
3-(7-methyl-2-oxo-1H-quinolin-3-yl)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
CID 53174881
6-methyl-3-(3-morpholin-4-ylpropyl)-1H-benzimidazol-2-one
CID 67560491
7-methyl-3-[3-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]-3-oxopropyl]-1H-quinolin-2-one
CID 110424937
7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one
CID 53174869
7-methyl-3-(methylaminomethyl)-1H-quinolin-2-one
CID 664663

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one?
The IUPAC name of 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one (CID 170870829) is 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one.
What is the SMILES notation for 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one?
The canonical SMILES for 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one is Cc1ccc2cc(CCCN3CCOCC3)c(=O)[nH]c2c1.
What is the InChIKey of 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one?
The InChIKey is BUJDXWLLHFATKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-13-4-5-14-12-15(17(20)18-16(14)11-13)3-2-6-19-7-9-21-10-8-19/h4-5,11-12H,2-3,6-10H2,1H3,(H,18,20).
What are the key properties of 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one?
7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one has a molecular weight of 286.38 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one is sourced from PubChem (CID 170870829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).