N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide

C20H30N2O2 — CID 18150652

IUPACN-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C20H30N2O2/c23-19(10-9-18-7-3-1-4-8-18)21-17-20(11-5-2-6-12-20)22-13-15-24-16-14-22/h1,3-4,7-8H,2,5-6,9-17H2,(H,21,23)
InChIKeyIYTNNJHCGXHSMX-UHFFFAOYSA-N
MW330.47 g/mol
LogP2.77
Rot. Bonds6

About N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide

N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide (PubChem CID 18150652) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide
PubChem CID18150652
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC NameN-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C20H30N2O2/c23-19(10-9-18-7-3-1-4-8-18)21-17-20(11-5-2-6-12-20)22-13-15-24-16-14-22/h1,3-4,7-8H,2,5-6,9-17H2,(H,21,23)
InChIKeyIYTNNJHCGXHSMX-UHFFFAOYSA-N
XLogP2.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(3-phenylpropylsulfonyl)acetamide
CID 39711649
3-(3,4-dimethoxyphenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 37259435
3-[4-(diethylsulfamoyl)phenyl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 31328580
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-(1-phenylbenzimidazol-2-yl)propanamide
CID 55332413
3-(3-fluorophenyl)-N-[(1-methyl-4-morpholin-4-ylpiperidin-4-yl)methyl]propanamide
CID 110622703
2-(2-chlorophenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 20994960
[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl] 2-phenylbutanoate
CID 55475345
2-(3,4-dichlorophenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 2542286
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-(4-oxo-1-phenyl-5H-pyrazolo[5,4-d]pyrimidin-6-yl)propanamide
CID 135926182
3-[3-[[2-(1-morpholin-4-ylcyclopentyl)acetyl]amino]phenyl]propanoic acid
CID 120613884
N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide
CID 134015029
3-phenoxy-N-[(4-piperidin-1-yloxan-4-yl)methyl]propanamide
CID 56787210

Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide (CID 18150652) is N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide is O=C(CCc1ccccc1)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide?
The InChIKey is IYTNNJHCGXHSMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O2/c23-19(10-9-18-7-3-1-4-8-18)21-17-20(11-5-2-6-12-20)22-13-15-24-16-14-22/h1,3-4,7-8H,2,5-6,9-17H2,(H,21,23).
What are the key properties of N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide?
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide has a molecular weight of 330.47 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide is sourced from PubChem (CID 18150652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).