N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide

C13H27N3O — CID 60805793

IUPACN-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
SMILESCCC(C)NC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C13H27N3O/c1-4-11(3)15-13(17)10-16(5-2)12-6-8-14-9-7-12/h11-12,14H,4-10H2,1-3H3,(H,15,17)
InChIKeyQIJFJGKOPVDBMU-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.98
Rot. Bonds6

About N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide

N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide (PubChem CID 60805793) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
PubChem CID60805793
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
SMILESCCC(C)NC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C13H27N3O/c1-4-11(3)15-13(17)10-16(5-2)12-6-8-14-9-7-12/h11-12,14H,4-10H2,1-3H3,(H,15,17)
InChIKeyQIJFJGKOPVDBMU-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300316
2-[azepan-4-yl(ethyl)amino]-N-propan-2-ylacetamide
CID 103983310
2-[ethyl(pyrrolidin-3-yl)amino]-N-(6-methylheptan-2-yl)acetamide
CID 63299866
2-[ethyl(pyrrolidin-3-yl)amino]-N-pentan-3-ylacetamide
CID 63300371
N-pentan-2-yl-2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]acetamide
CID 64850232
2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide
CID 60806113
N-(ethylcarbamoyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60806622
N-pentan-3-yl-2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]acetamide
CID 64850427
N-butan-2-yl-3-piperidin-4-ylpropanamide
CID 62210305
N-butan-2-yl-3-piperidin-4-ylbutanamide
CID 119669606
N-(cyclopentylcarbamoyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60807146
N-propan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921653

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide (CID 60805793) is N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide is CCC(C)NC(=O)CN(CC)C1CCNCC1.
What is the InChIKey of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
The InChIKey is QIJFJGKOPVDBMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-4-11(3)15-13(17)10-16(5-2)12-6-8-14-9-7-12/h11-12,14H,4-10H2,1-3H3,(H,15,17).
What are the key properties of N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide?
N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide has a molecular weight of 241.38 g/mol, XLogP of 0.98, 6 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-[ethyl(piperidin-4-yl)amino]acetamide is sourced from PubChem (CID 60805793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).