2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide

C22H28N2O3 — CID 110166202

IUPAC2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide
SMILESCC(C)c1ccc(O)c(C(=O)NCc2ccc(CN3CCOCC3)cc2)c1
InChIInChI=1S/C22H28N2O3/c1-16(2)19-7-8-21(25)20(13-19)22(26)23-14-17-3-5-18(6-4-17)15-24-9-11-27-12-10-24/h3-8,13,16,25H,9-12,14-15H2,1-2H3,(H,23,26)
InChIKeyLFZOGUAQXNGJAD-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.28
Rot. Bonds6

About 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide

2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide (PubChem CID 110166202) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide
PubChem CID110166202
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide
SMILESCC(C)c1ccc(O)c(C(=O)NCc2ccc(CN3CCOCC3)cc2)c1
InChIInChI=1S/C22H28N2O3/c1-16(2)19-7-8-21(25)20(13-19)22(26)23-14-17-3-5-18(6-4-17)15-24-9-11-27-12-10-24/h3-8,13,16,25H,9-12,14-15H2,1-2H3,(H,23,26)
InChIKeyLFZOGUAQXNGJAD-UHFFFAOYSA-N
XLogP3.28
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-6-(morpholin-4-ylmethyl)-4-oxo-1-(4-propan-2-ylphenyl)quinoline-3-carboxamide
CID 5277712
5-amino-2-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 120640346
5-tert-butyl-2-hydroxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide
CID 110166198
2-methoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 17437691
2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
CID 110764588
3,4-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 17397484
2-bromo-5-methoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 17473474
N-benzyl-4-(morpholin-4-ylmethyl)benzamide
CID 786772
5-chloro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]furan-2-carboxamide
CID 29475175
(3R)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-phenylbutanamide
CID 26008683
4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
CID 31445799
tert-butyl N-[(1R)-1-[4-[[4-(morpholin-4-ylmethyl)phenyl]methylcarbamoyl]phenyl]ethyl]carbamate
CID 171673596

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide?
The IUPAC name of 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide (CID 110166202) is 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide.
What is the SMILES notation for 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide?
The canonical SMILES for 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide is CC(C)c1ccc(O)c(C(=O)NCc2ccc(CN3CCOCC3)cc2)c1.
What is the InChIKey of 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide?
The InChIKey is LFZOGUAQXNGJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-16(2)19-7-8-21(25)20(13-19)22(26)23-14-17-3-5-18(6-4-17)15-24-9-11-27-12-10-24/h3-8,13,16,25H,9-12,14-15H2,1-2H3,(H,23,26).
What are the key properties of 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide?
2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide has a molecular weight of 368.48 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-5-propan-2-ylbenzamide is sourced from PubChem (CID 110166202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).