2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide

C17H22N2O3 — CID 109133281

IUPAC2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide
SMILESCC(NC(=O)C1CC1C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C17H22N2O3/c1-12(13-5-3-2-4-6-13)18-16(20)14-11-15(14)17(21)19-7-9-22-10-8-19/h2-6,12,14-15H,7-11H2,1H3,(H,18,20)
InChIKeyRGHDVNIWBPUETF-UHFFFAOYSA-N
MW302.37 g/mol
LogP1.36
Rot. Bonds4

About 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide

2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide (PubChem CID 109133281) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide
PubChem CID109133281
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide
SMILESCC(NC(=O)C1CC1C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C17H22N2O3/c1-12(13-5-3-2-4-6-13)18-16(20)14-11-15(14)17(21)19-7-9-22-10-8-19/h2-6,12,14-15H,7-11H2,1H3,(H,18,20)
InChIKeyRGHDVNIWBPUETF-UHFFFAOYSA-N
XLogP1.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide?
The IUPAC name of 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide (CID 109133281) is 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide is CC(NC(=O)C1CC1C(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide?
The InChIKey is RGHDVNIWBPUETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3/c1-12(13-5-3-2-4-6-13)18-16(20)14-11-15(14)17(21)19-7-9-22-10-8-19/h2-6,12,14-15H,7-11H2,1H3,(H,18,20).
What are the key properties of 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide?
2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide has a molecular weight of 302.37 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholine-4-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 109133281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).