N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide

C16H21ClN2O2 — CID 110446378

IUPACN-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide
SMILESCC(C(=O)NC1(c2ccc(Cl)cc2)CC1)N1CCOCC1
InChIInChI=1S/C16H21ClN2O2/c1-12(19-8-10-21-11-9-19)15(20)18-16(6-7-16)13-2-4-14(17)5-3-13/h2-5,12H,6-11H2,1H3,(H,18,20)
InChIKeyWJEKNHHCUQZJBD-UHFFFAOYSA-N
MW308.81 g/mol
LogP2.17
Rot. Bonds4

About N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide

N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide (PubChem CID 110446378) has the molecular formula C16H21ClN2O2 and a molecular weight of 308.81 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide
PubChem CID110446378
Molecular FormulaC16H21ClN2O2
Molecular Weight308.81 g/mol
Exact Mass308.13
IUPAC NameN-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide
SMILESCC(C(=O)NC1(c2ccc(Cl)cc2)CC1)N1CCOCC1
InChIInChI=1S/C16H21ClN2O2/c1-12(19-8-10-21-11-9-19)15(20)18-16(6-7-16)13-2-4-14(17)5-3-13/h2-5,12H,6-11H2,1H3,(H,18,20)
InChIKeyWJEKNHHCUQZJBD-UHFFFAOYSA-N
XLogP2.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.81
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(4-chlorophenyl)oxan-4-yl]-2-pyrazol-1-ylpropanamide
CID 146085233
N-(2-amino-4-chlorophenyl)-2-morpholin-4-ylpropanamide
CID 16779290
(2R)-N-[4-(4-fluorophenyl)oxan-4-yl]-2-pyrrol-1-ylpropanamide
CID 129434086
4-(4-chlorophenyl)-N-(3-methyl-2-morpholin-4-ylbutyl)oxane-4-carboxamide
CID 46978034
N-[1-(4-chlorophenyl)cyclopropyl]pyrrolidine-1-carboxamide
CID 110490806
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 46744278
N-(3,4-difluorophenyl)-2-morpholin-4-ylpropanamide
CID 46630811
2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N-cyclopentylpropanamide
CID 50983445
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]propanamide
CID 119867147
(2S)-2-(carbamoylamino)-N-[1-(4-chlorophenyl)cyclohexyl]propanamide
CID 95383338
N-(2,3-dichlorophenyl)-2-morpholin-4-ylpropanamide
CID 51167813
(1S,2S)-1-(4-chlorophenyl)-2-morpholin-4-ylpropan-1-ol
CID 177420176

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide?
The IUPAC name of N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide (CID 110446378) is N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide.
What is the SMILES notation for N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide?
The canonical SMILES for N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide is CC(C(=O)NC1(c2ccc(Cl)cc2)CC1)N1CCOCC1.
What is the InChIKey of N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide?
The InChIKey is WJEKNHHCUQZJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2O2/c1-12(19-8-10-21-11-9-19)15(20)18-16(6-7-16)13-2-4-14(17)5-3-13/h2-5,12H,6-11H2,1H3,(H,18,20).
What are the key properties of N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide?
N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide has a molecular weight of 308.81 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)cyclopropyl]-2-morpholin-4-ylpropanamide is sourced from PubChem (CID 110446378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).