cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone

C19H27NO2 — CID 124737738

IUPACcyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone
SMILESCC(C)c1ccc([C@H](C)N2CCO[C@@H](C(=O)C3CC3)C2)cc1
InChIInChI=1S/C19H27NO2/c1-13(2)15-4-6-16(7-5-15)14(3)20-10-11-22-18(12-20)19(21)17-8-9-17/h4-7,13-14,17-18H,8-12H2,1-3H3/t14-,18+/m0/s1
InChIKeyQFTINGOVVRYVEE-KBXCAEBGSA-N
MW301.43 g/mol
LogP3.55
Rot. Bonds5

About cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone

cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone (PubChem CID 124737738) has the molecular formula C19H27NO2 and a molecular weight of 301.43 g/mol. Its IUPAC name is cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone
PubChem CID124737738
Molecular FormulaC19H27NO2
Molecular Weight301.43 g/mol
Exact Mass301.20
IUPAC Namecyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone
SMILESCC(C)c1ccc([C@H](C)N2CCO[C@@H](C(=O)C3CC3)C2)cc1
InChIInChI=1S/C19H27NO2/c1-13(2)15-4-6-16(7-5-15)14(3)20-10-11-22-18(12-20)19(21)17-8-9-17/h4-7,13-14,17-18H,8-12H2,1-3H3/t14-,18+/m0/s1
InChIKeyQFTINGOVVRYVEE-KBXCAEBGSA-N
XLogP3.55
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(4-tert-butylphenyl)ethyl]morpholine-2-carboxylic acid
CID 65067070
(2S)-4-[(1R)-1-(4-tert-butylphenyl)ethyl]morpholine-2-carboxylic acid
CID 129371945
4-[1-[4-(2-methylpropyl)phenyl]ethyl]morpholine-2-carboxylic acid
CID 65067615
[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol
CID 99108798
phenyl-[(2R)-4-[(1S)-1-phenylethyl]morpholin-2-yl]methanone
CID 71094651
4-[1-(3,4-difluorophenyl)ethyl]morpholine-2-carboxylic acid
CID 65067562
cyclopropyl-[1-(1-phenylethyl)pyrrolidin-3-yl]methanone
CID 22633923
4-[1-(2-methylmorpholin-4-yl)ethyl]phenol
CID 82977780
(2S)-2-[(2R)-2-(cyclopropanecarbonyl)morpholin-4-yl]-N-(propan-2-ylcarbamoyl)propanamide
CID 124729166
4-[1-(4-methyl-3-nitrophenyl)ethyl]morpholine-2-carboxylic acid
CID 65067117
2-[4-[1-(4-bromophenyl)ethyl]morpholin-2-yl]acetic acid
CID 66433752
(3R)-1-[(1S)-1-(4-chlorophenyl)ethyl]pyrrolidine-3-carboxylic acid
CID 124677629

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone?
The IUPAC name of cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone (CID 124737738) is cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone.
What is the SMILES notation for cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone?
The canonical SMILES for cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone is CC(C)c1ccc([C@H](C)N2CCO[C@@H](C(=O)C3CC3)C2)cc1.
What is the InChIKey of cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone?
The InChIKey is QFTINGOVVRYVEE-KBXCAEBGSA-N. The full InChI is InChI=1S/C19H27NO2/c1-13(2)15-4-6-16(7-5-15)14(3)20-10-11-22-18(12-20)19(21)17-8-9-17/h4-7,13-14,17-18H,8-12H2,1-3H3/t14-,18+/m0/s1.
What are the key properties of cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone?
cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone has a molecular weight of 301.43 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone is sourced from PubChem (CID 124737738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).