cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone

C19H26FN3O2 — CID 92988035

IUPACcyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone
SMILESO=C(C1CC1)N1CCO[C@H](CN2CCN(c3ccc(F)cc3)CC2)C1
InChIInChI=1S/C19H26FN3O2/c20-16-3-5-17(6-4-16)22-9-7-21(8-10-22)13-18-14-23(11-12-25-18)19(24)15-1-2-15/h3-6,15,18H,1-2,7-14H2/t18-/m1/s1
InChIKeyPRDCVWGFFUBTGY-GOSISDBHSA-N
MW347.43 g/mol
LogP1.59
Rot. Bonds4

About cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone

cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone (PubChem CID 92988035) has the molecular formula C19H26FN3O2 and a molecular weight of 347.43 g/mol. Its IUPAC name is cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone
PubChem CID92988035
Molecular FormulaC19H26FN3O2
Molecular Weight347.43 g/mol
Exact Mass347.20
IUPAC Namecyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone
SMILESO=C(C1CC1)N1CCO[C@H](CN2CCN(c3ccc(F)cc3)CC2)C1
InChIInChI=1S/C19H26FN3O2/c20-16-3-5-17(6-4-16)22-9-7-21(8-10-22)13-18-14-23(11-12-25-18)19(24)15-1-2-15/h3-6,15,18H,1-2,7-14H2/t18-/m1/s1
InChIKeyPRDCVWGFFUBTGY-GOSISDBHSA-N
XLogP1.59
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2,4-difluorophenyl)-[2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone
CID 42849221
cyclopropyl-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81208707
cyclopentyl-[3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]methanone
CID 46062658
cyclopropyl-[4-[2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-1-yl]methanone
CID 134044230
N-(4-fluorophenyl)-2-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]morpholine-4-carbothioamide
CID 46059468
[4-(4-fluorophenyl)piperazin-1-yl]-[1-(oxolane-2-carbonyl)piperidin-4-yl]methanone
CID 113004957
[4-(4-fluorophenyl)piperazin-1-yl]-(1-phenylpiperidin-4-yl)methanone
CID 17152277
cyclobutyl-[(3S)-3-[4-(4-fluorophenyl)piperazin-1-yl]piperidin-1-yl]methanone
CID 92986014
[1-(4-fluorophenyl)cyclopropyl]-[(2S)-2-(morpholin-4-ylmethyl)-1,4-oxazepan-4-yl]methanone
CID 97127856
N-[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]phenyl]-2-(4-fluorophenyl)acetamide
CID 112502808
[4-(4-fluorophenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 3513759
4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]cyclohexan-1-ol;bis(2,2,2-trifluoroacetic acid)
CID 154924391

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone?
The IUPAC name of cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone (CID 92988035) is cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone.
What is the SMILES notation for cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone?
The canonical SMILES for cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone is O=C(C1CC1)N1CCO[C@H](CN2CCN(c3ccc(F)cc3)CC2)C1.
What is the InChIKey of cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone?
The InChIKey is PRDCVWGFFUBTGY-GOSISDBHSA-N. The full InChI is InChI=1S/C19H26FN3O2/c20-16-3-5-17(6-4-16)22-9-7-21(8-10-22)13-18-14-23(11-12-25-18)19(24)15-1-2-15/h3-6,15,18H,1-2,7-14H2/t18-/m1/s1.
What are the key properties of cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone?
cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone has a molecular weight of 347.43 g/mol, XLogP of 1.59, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[(2R)-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]morpholin-4-yl]methanone is sourced from PubChem (CID 92988035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).