2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide

C24H29FN2O2 — CID 110420949

IUPAC2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide
SMILESO=C(NCC(Cc1ccccc1)N1CCOCC1)C(c1ccc(F)cc1)C1CC1
InChIInChI=1S/C24H29FN2O2/c25-21-10-8-20(9-11-21)23(19-6-7-19)24(28)26-17-22(27-12-14-29-15-13-27)16-18-4-2-1-3-5-18/h1-5,8-11,19,22-23H,6-7,12-17H2,(H,26,28)
InChIKeyUHKMGKMFCDTBDK-UHFFFAOYSA-N
MW396.51 g/mol
LogP3.38
Rot. Bonds8

About 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide

2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide (PubChem CID 110420949) has the molecular formula C24H29FN2O2 and a molecular weight of 396.51 g/mol. Its IUPAC name is 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide
PubChem CID110420949
Molecular FormulaC24H29FN2O2
Molecular Weight396.51 g/mol
Exact Mass396.22
IUPAC Name2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide
SMILESO=C(NCC(Cc1ccccc1)N1CCOCC1)C(c1ccc(F)cc1)C1CC1
InChIInChI=1S/C24H29FN2O2/c25-21-10-8-20(9-11-21)23(19-6-7-19)24(28)26-17-22(27-12-14-29-15-13-27)16-18-4-2-1-3-5-18/h1-5,8-11,19,22-23H,6-7,12-17H2,(H,26,28)
InChIKeyUHKMGKMFCDTBDK-UHFFFAOYSA-N
XLogP3.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.51
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 110355576
2-cyclopropyl-N-(3-phenyl-2-pyrrolidin-1-ylpropyl)propanamide
CID 110611083
benzyl N-(2-morpholin-4-yl-3-phenylpropyl)carbamate
CID 110403830
1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea
CID 110403837
1-(oxan-4-yl)-3-(3-phenyl-2-piperidin-1-ylpropyl)urea
CID 110611113
N-(2-morpholin-4-yl-3-phenylpropyl)pyridine-2-carboxamide
CID 110665487
3-(4-methoxyphenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)butanamide
CID 110418357
N-[2-[[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]amino]-2-oxoethyl]-2-phenylacetamide
CID 51163264
(2R)-2-morpholin-4-yl-3-phenylpropan-1-ol
CID 107861547
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylpropanamide
CID 30334846
2-amino-N-(2-morpholin-4-yl-2-phenylethyl)-3-phenylpropanamide;dihydrochloride
CID 119853212
N-(3-phenyl-2-piperidin-1-ylpropyl)cyclopropanecarboxamide
CID 110403968

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide?
The IUPAC name of 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide (CID 110420949) is 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide.
What is the SMILES notation for 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide?
The canonical SMILES for 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide is O=C(NCC(Cc1ccccc1)N1CCOCC1)C(c1ccc(F)cc1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide?
The InChIKey is UHKMGKMFCDTBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29FN2O2/c25-21-10-8-20(9-11-21)23(19-6-7-19)24(28)26-17-22(27-12-14-29-15-13-27)16-18-4-2-1-3-5-18/h1-5,8-11,19,22-23H,6-7,12-17H2,(H,26,28).
What are the key properties of 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide?
2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide has a molecular weight of 396.51 g/mol, XLogP of 3.38, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide is sourced from PubChem (CID 110420949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).