3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one

C19H22N2O3 — CID 136566373

IUPAC3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one
SMILESO=C(Cc1cc2ccccc2[nH]c1=O)N1CCOCC1CC1CC1
InChIInChI=1S/C19H22N2O3/c22-18(21-7-8-24-12-16(21)9-13-5-6-13)11-15-10-14-3-1-2-4-17(14)20-19(15)23/h1-4,10,13,16H,5-9,11-12H2,(H,20,23)
InChIKeyHNSJXAJAEALXSA-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.10
Rot. Bonds4

About 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one

3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one (PubChem CID 136566373) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one
PubChem CID136566373
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one
SMILESO=C(Cc1cc2ccccc2[nH]c1=O)N1CCOCC1CC1CC1
InChIInChI=1S/C19H22N2O3/c22-18(21-7-8-24-12-16(21)9-13-5-6-13)11-15-10-14-3-1-2-4-17(14)20-19(15)23/h1-4,10,13,16H,5-9,11-12H2,(H,20,23)
InChIKeyHNSJXAJAEALXSA-UHFFFAOYSA-N
XLogP2.10
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one?
The IUPAC name of 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one (CID 136566373) is 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one?
The canonical SMILES for 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one is O=C(Cc1cc2ccccc2[nH]c1=O)N1CCOCC1CC1CC1.
What is the InChIKey of 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one?
The InChIKey is HNSJXAJAEALXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c22-18(21-7-8-24-12-16(21)9-13-5-6-13)11-15-10-14-3-1-2-4-17(14)20-19(15)23/h1-4,10,13,16H,5-9,11-12H2,(H,20,23).
What are the key properties of 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one?
3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one has a molecular weight of 326.40 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 3-[2-[3-(cyclopropylmethyl)morpholin-4-yl]-2-oxoethyl]-1H-quinolin-2-one is sourced from PubChem (CID 136566373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).