N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide

C14H29N3O4S — CID 113066319

IUPACN-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide
SMILESCCCCC(=O)NCCN(CCN1CCOCC1)S(C)(=O)=O
InChIInChI=1S/C14H29N3O4S/c1-3-4-5-14(18)15-6-7-17(22(2,19)20)9-8-16-10-12-21-13-11-16/h3-13H2,1-2H3,(H,15,18)
InChIKeyMLHBRJFYVWOJFU-UHFFFAOYSA-N
MW335.47 g/mol
LogP-0.11
Rot. Bonds10

About N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide

N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide (PubChem CID 113066319) has the molecular formula C14H29N3O4S and a molecular weight of 335.47 g/mol. Its IUPAC name is N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide
PubChem CID113066319
Molecular FormulaC14H29N3O4S
Molecular Weight335.47 g/mol
Exact Mass335.19
IUPAC NameN-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide
SMILESCCCCC(=O)NCCN(CCN1CCOCC1)S(C)(=O)=O
InChIInChI=1S/C14H29N3O4S/c1-3-4-5-14(18)15-6-7-17(22(2,19)20)9-8-16-10-12-21-13-11-16/h3-13H2,1-2H3,(H,15,18)
InChIKeyMLHBRJFYVWOJFU-UHFFFAOYSA-N
XLogP-0.11
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.47
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-3-[methylsulfonyl(2-morpholin-4-ylethyl)amino]propanamide
CID 113138237
N-(2-morpholin-4-ylethyl)pentanamide;sulfuric acid
CID 162122494
2-[methylsulfonyl(pentyl)amino]-N-(2-morpholin-4-ylethyl)acetamide
CID 113153386
N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]methanesulfonamide
CID 113066365
N-(3-morpholin-4-ylpropyl)butanamide
CID 4162480
N-(3-methylbutyl)-2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]acetamide
CID 113150008
N-cyclopropyl-3-[methylsulfonyl(2-morpholin-4-ylethyl)amino]propanamide
CID 113138235
N-(3-morpholin-4-ylpropyl)octadecanamide;phosphoric acid
CID 172692510
(Z)-N-(2-morpholin-4-ylethyl)octadec-9-enamide
CID 169211001
3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide
CID 109016748
N-cyclopropyl-2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]acetamide
CID 113149952
5-hydroxy-N-(3-morpholin-4-ylpropyl)pentanamide
CID 79199883

Frequently Asked Questions

What is the IUPAC name of N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide?
The IUPAC name of N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide (CID 113066319) is N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide.
What is the SMILES notation for N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide?
The canonical SMILES for N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide is CCCCC(=O)NCCN(CCN1CCOCC1)S(C)(=O)=O.
What is the InChIKey of N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide?
The InChIKey is MLHBRJFYVWOJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O4S/c1-3-4-5-14(18)15-6-7-17(22(2,19)20)9-8-16-10-12-21-13-11-16/h3-13H2,1-2H3,(H,15,18).
What are the key properties of N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide?
N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide has a molecular weight of 335.47 g/mol, XLogP of -0.11, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methylsulfonyl(2-morpholin-4-ylethyl)amino]ethyl]pentanamide is sourced from PubChem (CID 113066319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).