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

C12H25N3O — CID 60806113

IUPAC2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C12H25N3O/c1-3-7-14-12(16)10-15(4-2)11-5-8-13-9-6-11/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyZGQSSJXQKXGCSI-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.59
Rot. Bonds6

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

2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide (PubChem CID 60806113) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide
PubChem CID60806113
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C12H25N3O/c1-3-7-14-12(16)10-15(4-2)11-5-8-13-9-6-11/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyZGQSSJXQKXGCSI-UHFFFAOYSA-N
XLogP0.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]-N-propylacetamide
CID 64851985
N-butyl-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300417
N-(ethylcarbamoyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60806622
N-ethyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60807335
N-butan-2-yl-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60805793
2-[ethyl(piperidin-4-ylmethyl)amino]-N-propylacetamide
CID 79716409
N-butyl-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 55245115
2-[methyl-[2-[methyl(piperidin-4-yl)amino]acetyl]amino]-N-propylacetamide;hydrochloride
CID 119913381
2-[azepan-4-yl(ethyl)amino]-N-propan-2-ylacetamide
CID 103983310
N-(cyclopropylmethyl)-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60806815
3-[cyclopropyl-[2-oxo-2-(propylamino)ethyl]amino]propanoic acid
CID 60839017
N-(cyclopentylcarbamoyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60807146

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide?
The IUPAC name of 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide (CID 60806113) is 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide?
The canonical SMILES for 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide is CCCNC(=O)CN(CC)C1CCNCC1.
What is the InChIKey of 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide?
The InChIKey is ZGQSSJXQKXGCSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-3-7-14-12(16)10-15(4-2)11-5-8-13-9-6-11/h11,13H,3-10H2,1-2H3,(H,14,16).
What are the key properties of 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide?
2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide has a molecular weight of 227.35 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(piperidin-4-yl)amino]-N-propylacetamide is sourced from PubChem (CID 60806113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).