N-butan-2-yl-4-morpholin-4-ylbenzamide

C15H22N2O2 — CID 47147969

IUPACN-butan-2-yl-4-morpholin-4-ylbenzamide
SMILESCCC(C)NC(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-3-12(2)16-15(18)13-4-6-14(7-5-13)17-8-10-19-11-9-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyJGZALIIOOPXTIS-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.05
Rot. Bonds4

About N-butan-2-yl-4-morpholin-4-ylbenzamide

N-butan-2-yl-4-morpholin-4-ylbenzamide (PubChem CID 47147969) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-butan-2-yl-4-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-butan-2-yl-4-morpholin-4-ylbenzamide
PubChem CID47147969
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-butan-2-yl-4-morpholin-4-ylbenzamide
SMILESCCC(C)NC(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-3-12(2)16-15(18)13-4-6-14(7-5-13)17-8-10-19-11-9-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyJGZALIIOOPXTIS-UHFFFAOYSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide
CID 2863525
N-butan-2-yl-5-morpholin-4-ylpyridine-3-carboxamide
CID 109225123
N-butan-2-yl-5-morpholin-4-ylpyridine-2-carboxamide
CID 109181400
N-[(1S)-1-(4-methylphenyl)propyl]-4-morpholin-4-ylbenzamide
CID 94018845
N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-morpholin-4-ylbenzamide
CID 92674988
N-[(2R)-butan-2-yl]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide
CID 1362793
N-butan-2-yl-4-morpholin-4-ylquinazoline-6-carboxamide
CID 71842372
N-(2,2-dimethylpropyl)-4-morpholin-4-ylbenzamide
CID 110474046
N-[1-(4-methoxy-3-methylphenyl)propyl]-4-morpholin-4-ylbenzamide
CID 133161272
1-butan-2-yl-2-methyl-3-[(4-morpholin-4-ylphenyl)methyl]guanidine
CID 110944242
2-[[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]-methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 8592894
4-amino-N-butan-2-ylbenzamide
CID 3503917

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-4-morpholin-4-ylbenzamide?
The IUPAC name of N-butan-2-yl-4-morpholin-4-ylbenzamide (CID 47147969) is N-butan-2-yl-4-morpholin-4-ylbenzamide.
What is the SMILES notation for N-butan-2-yl-4-morpholin-4-ylbenzamide?
The canonical SMILES for N-butan-2-yl-4-morpholin-4-ylbenzamide is CCC(C)NC(=O)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-butan-2-yl-4-morpholin-4-ylbenzamide?
The InChIKey is JGZALIIOOPXTIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-12(2)16-15(18)13-4-6-14(7-5-13)17-8-10-19-11-9-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-butan-2-yl-4-morpholin-4-ylbenzamide?
N-butan-2-yl-4-morpholin-4-ylbenzamide has a molecular weight of 262.35 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-4-morpholin-4-ylbenzamide is sourced from PubChem (CID 47147969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).