N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide

C13H27N3O — CID 113283097

IUPACN-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
SMILESCCC(C)NC(=O)CN1CCC(C)(NC)CC1
InChIInChI=1S/C13H27N3O/c1-5-11(2)15-12(17)10-16-8-6-13(3,14-4)7-9-16/h11,14H,5-10H2,1-4H3,(H,15,17)
InChIKeyLRWLEWVWEWKFJL-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.98
Rot. Bonds5

About N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide

N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide (PubChem CID 113283097) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
PubChem CID113283097
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
SMILESCCC(C)NC(=O)CN1CCC(C)(NC)CC1
InChIInChI=1S/C13H27N3O/c1-5-11(2)15-12(17)10-16-8-6-13(3,14-4)7-9-16/h11,14H,5-10H2,1-4H3,(H,15,17)
InChIKeyLRWLEWVWEWKFJL-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetamide
CID 51077599
N-butan-2-yl-2-[4-[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 134045413
N-butan-2-yl-2-[4-[(2R)-2-hydroxybutyl]piperazin-1-yl]acetamide
CID 111487266
2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(3-propan-2-yloxypropyl)acetamide
CID 115305282
3-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-2-methylpropanoic acid
CID 82323000
N-butan-2-yl-2-[4-[(3-methylpyrrolidin-3-yl)methyl]piperazin-1-yl]acetamide;hydrochloride
CID 120898228
2-[4-(4-aminobutyl)piperazin-1-yl]-N-butan-2-ylacetamide
CID 43252753
2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide
CID 115305331
1-(azepan-1-yl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]ethanone
CID 115304923
3-[4-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]piperazin-1-yl]-N-(methylcarbamoyl)propanamide
CID 94007632
3-methyl-1-[2-oxo-2-(pentan-2-ylamino)ethyl]pyrrolidine-3-carboxylic acid
CID 63148953
N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide
CID 63852912

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide?
The IUPAC name of N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide (CID 113283097) is N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide?
The canonical SMILES for N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide is CCC(C)NC(=O)CN1CCC(C)(NC)CC1.
What is the InChIKey of N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide?
The InChIKey is LRWLEWVWEWKFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-11(2)15-12(17)10-16-8-6-13(3,14-4)7-9-16/h11,14H,5-10H2,1-4H3,(H,15,17).
What are the key properties of N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide?
N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide has a molecular weight of 241.38 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 113283097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).