N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide

C16H29N3O3 — CID 119726235

IUPACN-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide
SMILESCC(CC(=O)N(C)CC(=O)N1CCOCC1)C1CCNCC1
InChIInChI=1S/C16H29N3O3/c1-13(14-3-5-17-6-4-14)11-15(20)18(2)12-16(21)19-7-9-22-10-8-19/h13-14,17H,3-12H2,1-2H3
InChIKeyDSODVMRBBLPCOB-UHFFFAOYSA-N
MW311.43 g/mol
LogP0.33
Rot. Bonds5

About N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide

N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide (PubChem CID 119726235) has the molecular formula C16H29N3O3 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide.

Molecular Properties

Compound NameN-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide
PubChem CID119726235
Molecular FormulaC16H29N3O3
Molecular Weight311.43 g/mol
Exact Mass311.22
IUPAC NameN-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide
SMILESCC(CC(=O)N(C)CC(=O)N1CCOCC1)C1CCNCC1
InChIInChI=1S/C16H29N3O3/c1-13(14-3-5-17-6-4-14)11-15(20)18(2)12-16(21)19-7-9-22-10-8-19/h13-14,17H,3-12H2,1-2H3
InChIKeyDSODVMRBBLPCOB-UHFFFAOYSA-N
XLogP0.33
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[methyl(pyrrolidin-3-yl)amino]-1-morpholin-4-ylethanone
CID 63301630
3-piperidin-4-yl-1-pyrrolidin-1-ylbutan-1-one;hydrochloride
CID 119669978
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-3-piperidin-4-ylbutan-1-one;dihydrochloride
CID 119852053
1-(2-methylmorpholin-4-yl)-3-piperidin-4-ylbutan-1-one
CID 119698730
N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119727188
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)acetamide;hydrochloride
CID 119726228
N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)piperidine-3-carboxamide;hydrochloride
CID 119290915
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
2-[methyl(oxan-4-yl)amino]-1-piperazin-1-ylethanone
CID 43611217
N,4-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)pentanamide
CID 43603175
3-cyclopropyl-3-hydroxy-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
CID 156723433
N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119841958

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide?
The IUPAC name of N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide (CID 119726235) is N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide.
What is the SMILES notation for N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide?
The canonical SMILES for N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide is CC(CC(=O)N(C)CC(=O)N1CCOCC1)C1CCNCC1.
What is the InChIKey of N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide?
The InChIKey is DSODVMRBBLPCOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O3/c1-13(14-3-5-17-6-4-14)11-15(20)18(2)12-16(21)19-7-9-22-10-8-19/h13-14,17H,3-12H2,1-2H3.
What are the key properties of N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide?
N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide has a molecular weight of 311.43 g/mol, XLogP of 0.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-piperidin-4-ylbutanamide is sourced from PubChem (CID 119726235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).