morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone

C21H27N3O3 — CID 92639103

IUPACmorpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone
SMILESCCCN1CCO[C@H](c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1
InChIInChI=1S/C21H27N3O3/c1-2-7-23-8-13-27-20(15-23)19-14-17(16-5-3-4-6-18(16)22-19)21(25)24-9-11-26-12-10-24/h3-6,14,20H,2,7-13,15H2,1H3/t20-/m0/s1
InChIKeyNXQNHXMWBBHZIM-FQEVSTJZSA-N
MW369.47 g/mol
LogP2.49
Rot. Bonds4

About morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone

morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone (PubChem CID 92639103) has the molecular formula C21H27N3O3 and a molecular weight of 369.47 g/mol. Its IUPAC name is morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone
PubChem CID92639103
Molecular FormulaC21H27N3O3
Molecular Weight369.47 g/mol
Exact Mass369.21
IUPAC Namemorpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone
SMILESCCCN1CCO[C@H](c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1
InChIInChI=1S/C21H27N3O3/c1-2-7-23-8-13-27-20(15-23)19-14-17(16-5-3-4-6-18(16)22-19)21(25)24-9-11-26-12-10-24/h3-6,14,20H,2,7-13,15H2,1H3/t20-/m0/s1
InChIKeyNXQNHXMWBBHZIM-FQEVSTJZSA-N
XLogP2.49
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]ethanone
CID 110251795
[2-[4-(morpholine-4-carbonyl)quinolin-2-yl]morpholin-4-yl]-phenylmethanone
CID 110251818
[2-[4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]quinolin-4-yl]-morpholin-4-ylmethanone
CID 110251874
[2-[(2S)-4-[(3-methoxyphenyl)methyl]morpholin-2-yl]quinolin-4-yl]-morpholin-4-ylmethanone
CID 92638405
morpholin-4-yl-(2-morpholin-2-ylquinolin-4-yl)methanone
CID 110089333
1-[3-[4-(morpholine-4-carbonyl)quinolin-2-yl]pyrrolidin-1-yl]-2-morpholin-4-ylethanone
CID 110251602
1-[(3R)-3-[4-(morpholine-4-carbonyl)quinolin-2-yl]pyrrolidin-1-yl]-2-morpholin-4-ylethanone
CID 92638688
[(2S)-2-[4-(4-methylpiperazine-1-carbonyl)quinolin-2-yl]morpholin-4-yl]-pyridin-4-ylmethanone
CID 92638221
[(2R)-2-[4-(4-methylpiperazine-1-carbonyl)quinolin-2-yl]morpholin-4-yl]-pyridin-2-ylmethanone
CID 92639213
2-[4-[2-(diethylamino)-2-oxoethyl]morpholin-2-yl]-N-propan-2-ylquinoline-4-carboxamide
CID 155983035
2-[(2R)-4-benzoylmorpholin-2-yl]-N-(2-methylpropyl)quinoline-4-carboxamide
CID 92638905
2-[4-(5-propyl-1,2-oxazole-3-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 110251986

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone?
The IUPAC name of morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone (CID 92639103) is morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone?
The canonical SMILES for morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone is CCCN1CCO[C@H](c2cc(C(=O)N3CCOCC3)c3ccccc3n2)C1.
What is the InChIKey of morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone?
The InChIKey is NXQNHXMWBBHZIM-FQEVSTJZSA-N. The full InChI is InChI=1S/C21H27N3O3/c1-2-7-23-8-13-27-20(15-23)19-14-17(16-5-3-4-6-18(16)22-19)21(25)24-9-11-26-12-10-24/h3-6,14,20H,2,7-13,15H2,1H3/t20-/m0/s1.
What are the key properties of morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone?
morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone has a molecular weight of 369.47 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[2-[(2S)-4-propylmorpholin-2-yl]quinolin-4-yl]methanone is sourced from PubChem (CID 92639103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).