N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide

C16H22N2O2 — CID 110647271

IUPACN-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide
SMILESO=C(CCc1ccc(N2CCOCC2)cc1)NC1CC1
InChIInChI=1S/C16H22N2O2/c19-16(17-14-4-5-14)8-3-13-1-6-15(7-2-13)18-9-11-20-12-10-18/h1-2,6-7,14H,3-5,8-12H2,(H,17,19)
InChIKeyBNIZMMPZXAFDDX-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.73
Rot. Bonds5

About N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide

N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide (PubChem CID 110647271) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide
PubChem CID110647271
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide
SMILESO=C(CCc1ccc(N2CCOCC2)cc1)NC1CC1
InChIInChI=1S/C16H22N2O2/c19-16(17-14-4-5-14)8-3-13-1-6-15(7-2-13)18-9-11-20-12-10-18/h1-2,6-7,14H,3-5,8-12H2,(H,17,19)
InChIKeyBNIZMMPZXAFDDX-UHFFFAOYSA-N
XLogP1.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186023
N-tert-butyl-3-(4-morpholin-4-ylphenyl)propanamide
CID 110649192
3-(4-bromophenyl)-N-(oxan-4-yl)propanamide
CID 175666639
N'-cyclopentyl-N-[2-(4-morpholin-4-ylphenyl)ethyl]oxamide
CID 16891637
4-[3-[[(4R)-oxepan-4-yl]amino]-3-oxopropyl]benzoic acid
CID 129402468
N-[1-(4-morpholin-4-ylphenyl)sulfonylpiperidin-3-yl]-3-phenylpropanamide
CID 155465241
N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110650035
N-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]-3-phenylpropanamide
CID 46037987
3-(4-morpholin-4-ylsulfonylphenyl)-N-piperidin-4-ylpropanamide
CID 119390011
3-(4-fluorophenyl)-N-(4-hydroxycyclohexyl)propanamide
CID 43392085
N-(3,4-dimethylphenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110649726
N-(4-cyanophenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110651342

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide (CID 110647271) is N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide is O=C(CCc1ccc(N2CCOCC2)cc1)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide?
The InChIKey is BNIZMMPZXAFDDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c19-16(17-14-4-5-14)8-3-13-1-6-15(7-2-13)18-9-11-20-12-10-18/h1-2,6-7,14H,3-5,8-12H2,(H,17,19).
What are the key properties of N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide?
N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide has a molecular weight of 274.36 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 110647271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).