2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one

C23H30N2O2 — CID 57110605

IUPAC2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
SMILESCN(C)C(CCCc1ccccc1)C(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C23H30N2O2/c1-24(2)22(10-6-9-19-7-4-3-5-8-19)23(26)20-11-13-21(14-12-20)25-15-17-27-18-16-25/h3-5,7-8,11-14,22H,6,9-10,15-18H2,1-2H3
InChIKeyHSQQRHKBMYTMPD-UHFFFAOYSA-N
MW366.51 g/mol
LogP3.66
Rot. Bonds8

About 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one

2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one (PubChem CID 57110605) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one.

Molecular Properties

Compound Name2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
PubChem CID57110605
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
SMILESCN(C)C(CCCc1ccccc1)C(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C23H30N2O2/c1-24(2)22(10-6-9-19-7-4-3-5-8-19)23(26)20-11-13-21(14-12-20)25-15-17-27-18-16-25/h3-5,7-8,11-14,22H,6,9-10,15-18H2,1-2H3
InChIKeyHSQQRHKBMYTMPD-UHFFFAOYSA-N
XLogP3.66
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)butan-1-one;1-(4-morpholin-4-ylphenyl)-2-phenylethanone
CID 90024820
N,N-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-2-amine
CID 69032943
2-(dimethylamino)-1-[4-[(4-morpholin-4-ylphenyl)methyl]phenyl]-2,5-diphenylpentan-1-one
CID 174755377
1-(3,4-dimethoxyphenyl)-2-(dimethylamino)-5-phenylpentan-1-one
CID 69490048
2-[(4-morpholin-4-ylbenzoyl)-(2-phenylethyl)amino]acetic acid
CID 119347604
2-benzylbutanal;2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)propan-1-one
CID 175047147
2,2-bis(methylamino)-1-(4-morpholin-4-ylphenyl)-4-phenylbutan-1-one
CID 174831575
[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone
CID 174435606
2-amino-4,4-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 57126058
1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one
CID 155754250
2,6-bis(dimethylamino)-3,5-bis(4-morpholin-4-ylphenyl)-1,7-diphenylheptan-4-one
CID 175073819
4-amino-2,2-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 68890716

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one?
The IUPAC name of 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one (CID 57110605) is 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one.
What is the SMILES notation for 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one?
The canonical SMILES for 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one is CN(C)C(CCCc1ccccc1)C(=O)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one?
The InChIKey is HSQQRHKBMYTMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-24(2)22(10-6-9-19-7-4-3-5-8-19)23(26)20-11-13-21(14-12-20)25-15-17-27-18-16-25/h3-5,7-8,11-14,22H,6,9-10,15-18H2,1-2H3.
What are the key properties of 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one?
2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one has a molecular weight of 366.51 g/mol, XLogP of 3.66, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one is sourced from PubChem (CID 57110605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).