(2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone

C20H21NO2 — CID 661533

IUPAC(2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone
SMILESO=C(C1CC1(c1ccccc1)c1ccccc1)N1CCOCC1
InChIInChI=1S/C20H21NO2/c22-19(21-11-13-23-14-12-21)18-15-20(18,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18H,11-15H2
InChIKeyPSSKPKBIRARCFR-UHFFFAOYSA-N
MW307.39 g/mol
LogP2.85
Rot. Bonds3

About (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone

(2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone (PubChem CID 661533) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone
PubChem CID661533
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name(2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone
SMILESO=C(C1CC1(c1ccccc1)c1ccccc1)N1CCOCC1
InChIInChI=1S/C20H21NO2/c22-19(21-11-13-23-14-12-21)18-15-20(18,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18H,11-15H2
InChIKeyPSSKPKBIRARCFR-UHFFFAOYSA-N
XLogP2.85
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone?
The IUPAC name of (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone (CID 661533) is (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone?
The canonical SMILES for (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone is O=C(C1CC1(c1ccccc1)c1ccccc1)N1CCOCC1.
What is the InChIKey of (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone?
The InChIKey is PSSKPKBIRARCFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c22-19(21-11-13-23-14-12-21)18-15-20(18,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18H,11-15H2.
What are the key properties of (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone?
(2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone has a molecular weight of 307.39 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-diphenylcyclopropyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 661533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).