morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone

C19H23N3O2 — CID 77081618

IUPACmorpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone
SMILESO=C([C@@H]1CCCN1Cc1cccc2ncccc12)N1CCOCC1
InChIInChI=1S/C19H23N3O2/c23-19(21-10-12-24-13-11-21)18-7-3-9-22(18)14-15-4-1-6-17-16(15)5-2-8-20-17/h1-2,4-6,8,18H,3,7,9-14H2/t18-/m0/s1
InChIKeyAQZWAVPHBZGOOD-SFHVURJKSA-N
MW325.41 g/mol
LogP2.06
Rot. Bonds3

About morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone

morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone (PubChem CID 77081618) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone
PubChem CID77081618
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Namemorpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone
SMILESO=C([C@@H]1CCCN1Cc1cccc2ncccc12)N1CCOCC1
InChIInChI=1S/C19H23N3O2/c23-19(21-10-12-24-13-11-21)18-7-3-9-22(18)14-15-4-1-6-17-16(15)5-2-8-20-17/h1-2,4-6,8,18H,3,7,9-14H2/t18-/m0/s1
InChIKeyAQZWAVPHBZGOOD-SFHVURJKSA-N
XLogP2.06
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 1-(quinolin-4-ylmethyl)pyrrolidine-2-carboxylate
CID 79232010
4-(quinolin-5-ylmethyl)-1,4-oxazepane
CID 29183639
[1-[(2,6-dichloro-4-pyridinyl)methyl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 71989099
methyl (2R)-1-(quinolin-4-ylmethyl)piperidine-2-carboxylate
CID 115537863
[(2S)-1-[(2-methylsulfanylpyrimidin-5-yl)methyl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 77096881
[(2S)-1-(isoquinoline-1-carbonyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 95619677
[(2S)-1-[(4-fluorophenyl)methyl]piperidin-2-yl]-morpholin-4-ylmethanone
CID 95176295
1-[(3aR,8aR)-1-(quinolin-5-ylmethyl)-2,3,3a,5,6,7,8,8a-octahydropyrrolo[3,2-b]azepin-4-yl]ethanone
CID 110136317
methyl 1-[(2-amino-3-pyridinyl)methyl]pyrrolidine-2-carboxylate
CID 55075318
[(2R)-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 96540784
1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide
CID 142687635
1-[1-(quinolin-4-ylmethyl)pyrrolidin-2-yl]propan-2-one
CID 79546140

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone (CID 77081618) is morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone is O=C([C@@H]1CCCN1Cc1cccc2ncccc12)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone?
The InChIKey is AQZWAVPHBZGOOD-SFHVURJKSA-N. The full InChI is InChI=1S/C19H23N3O2/c23-19(21-10-12-24-13-11-21)18-7-3-9-22(18)14-15-4-1-6-17-16(15)5-2-8-20-17/h1-2,4-6,8,18H,3,7,9-14H2/t18-/m0/s1.
What are the key properties of morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone?
morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone has a molecular weight of 325.41 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[(2S)-1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]methanone is sourced from PubChem (CID 77081618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).