N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide

C16H24N2O2 — CID 2863525

IUPACN-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide
SMILESCCC(C)NC(=O)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C16H24N2O2/c1-3-13(2)17-16(19)15-6-4-14(5-7-15)12-18-8-10-20-11-9-18/h4-7,13H,3,8-12H2,1-2H3,(H,17,19)
InChIKeySJLNEHHPDMHBQS-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.05
Rot. Bonds5

About N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide

N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide (PubChem CID 2863525) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide.

Molecular Properties

Compound NameN-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide
PubChem CID2863525
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide
SMILESCCC(C)NC(=O)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C16H24N2O2/c1-3-13(2)17-16(19)15-6-4-14(5-7-15)12-18-8-10-20-11-9-18/h4-7,13H,3,8-12H2,1-2H3,(H,17,19)
InChIKeySJLNEHHPDMHBQS-UHFFFAOYSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutan-2-yl)-4-(morpholin-4-ylmethyl)benzamide
CID 133244954
N-butan-2-yl-2-[[4-(morpholin-4-ylmethyl)benzoyl]amino]benzamide
CID 3259740
N-[(2R)-butan-2-yl]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide
CID 1362793
N-butan-2-yl-4-morpholin-4-ylbenzamide
CID 47147969
N-[(1S)-1-(4-methoxyphenyl)propyl]-4-(morpholin-4-ylmethyl)benzamide
CID 28579988
N-[(1R)-1-(3,4-dimethylphenyl)ethyl]-4-(morpholin-4-ylmethyl)benzamide
CID 94013989
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-4-(morpholin-4-ylmethyl)benzamide
CID 92677739
N-[(2R)-1-morpholin-4-ylpropan-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide
CID 94116750
N-[(3S,4R)-4-amino-1-hydroxy-2-oxopentan-3-yl]-4-[2-[4-(morpholin-4-ylmethyl)phenyl]ethyl]benzamide
CID 158328594
(2S,3R)-3-hydroxy-2-[[4-[4-(morpholin-4-ylmethyl)phenyl]sulfanylbenzoyl]amino]butanoic acid
CID 141486427
4-butan-2-yloxy-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 2940925
N-[3-hydroxy-1-(hydroxyamino)-1-oxobutan-2-yl]-4-[4-[4-(morpholin-4-ylmethyl)phenyl]piperazin-1-yl]benzamide
CID 91504815

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide (CID 2863525) is N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide is CCC(C)NC(=O)c1ccc(CN2CCOCC2)cc1.
What is the InChIKey of N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide?
The InChIKey is SJLNEHHPDMHBQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-13(2)17-16(19)15-6-4-14(5-7-15)12-18-8-10-20-11-9-18/h4-7,13H,3,8-12H2,1-2H3,(H,17,19).
What are the key properties of N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide?
N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.05, 5 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-ylmethyl)benzamide is sourced from PubChem (CID 2863525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).