2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide

C13H27N3O — CID 79716409

IUPAC2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(CC)CC1CCNCC1
InChIInChI=1S/C13H27N3O/c1-3-7-15-13(17)11-16(4-2)10-12-5-8-14-9-6-12/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyCFYZJKXRPIWTDU-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.83
Rot. Bonds7

About 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide

2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide (PubChem CID 79716409) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide
PubChem CID79716409
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(CC)CC1CCNCC1
InChIInChI=1S/C13H27N3O/c1-3-7-15-13(17)11-16(4-2)10-12-5-8-14-9-6-12/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyCFYZJKXRPIWTDU-UHFFFAOYSA-N
XLogP0.83
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl(piperidin-4-ylmethyl)amino]acetamide
CID 79716882
2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide
CID 60806113
2-[ethyl(piperidin-4-ylmethyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 79717044
2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide
CID 79704024
N-[3-(diethylamino)propyl]-2-piperidin-4-ylacetamide
CID 24707221
N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
CID 119929877
2-[ethyl(propyl)amino]-N-propylacetamide
CID 135183244
N-ethyl-2-methylidene-N-(piperidin-4-ylmethyl)butan-1-amine
CID 79716490
4-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]butanoic acid
CID 79717421
2-[methyl-[2-[methyl(piperidin-4-yl)amino]acetyl]amino]-N-propylacetamide;hydrochloride
CID 119913381
2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]-N-propylacetamide
CID 64851985
N-(2-chloro-3-pyridinyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide
CID 79703986

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide?
The IUPAC name of 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide (CID 79716409) is 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide?
The canonical SMILES for 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide is CCCNC(=O)CN(CC)CC1CCNCC1.
What is the InChIKey of 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide?
The InChIKey is CFYZJKXRPIWTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-3-7-15-13(17)11-16(4-2)10-12-5-8-14-9-6-12/h12,14H,3-11H2,1-2H3,(H,15,17).
What are the key properties of 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide?
2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide has a molecular weight of 241.38 g/mol, XLogP of 0.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide is sourced from PubChem (CID 79716409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).