2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide

C14H29N3O — CID 106632199

IUPAC2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(CC1CCCCN1)C(C)C
InChIInChI=1S/C14H29N3O/c1-4-8-16-14(18)11-17(12(2)3)10-13-7-5-6-9-15-13/h12-13,15H,4-11H2,1-3H3,(H,16,18)
InChIKeyKRJVVVSGSWVRAJ-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.37
Rot. Bonds7

About 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide

2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide (PubChem CID 106632199) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide
PubChem CID106632199
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(CC1CCCCN1)C(C)C
InChIInChI=1S/C14H29N3O/c1-4-8-16-14(18)11-17(12(2)3)10-13-7-5-6-9-15-13/h12-13,15H,4-11H2,1-3H3,(H,16,18)
InChIKeyKRJVVVSGSWVRAJ-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[piperidin-2-ylmethyl(propyl)amino]-N-propylacetamide
CID 106636145
N-cyclohexyl-2-[piperidin-2-ylmethyl(propan-2-yl)amino]acetamide
CID 106631855
N-(ethylcarbamoyl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614699
N-heptan-2-yl-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614832
2-[propan-2-yl-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide
CID 102819407
2-[piperidin-2-ylmethyl(propyl)amino]-N-(propylcarbamoyl)acetamide
CID 106635938
N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-[piperidin-2-ylmethyl(propan-2-yl)amino]acetamide
CID 106631945
N-ethyl-N-(2-methylprop-2-enyl)-2-[piperidin-2-ylmethyl(propan-2-yl)amino]acetamide
CID 106631822
N-[2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethyl]acetamide
CID 106614697
N-(3-methyl-1,2-oxazol-5-yl)-2-[piperidin-2-ylmethyl(propan-2-yl)amino]acetamide
CID 106632002
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen
CID 164555849
N-(2-cyanoethyl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106636144

Frequently Asked Questions

What is the IUPAC name of 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide?
The IUPAC name of 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide (CID 106632199) is 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide?
The canonical SMILES for 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide is CCCNC(=O)CN(CC1CCCCN1)C(C)C.
What is the InChIKey of 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide?
The InChIKey is KRJVVVSGSWVRAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-4-8-16-14(18)11-17(12(2)3)10-13-7-5-6-9-15-13/h12-13,15H,4-11H2,1-3H3,(H,16,18).
What are the key properties of 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide?
2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide has a molecular weight of 255.41 g/mol, XLogP of 1.37, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[piperidin-2-ylmethyl(propan-2-yl)amino]-N-propylacetamide is sourced from PubChem (CID 106632199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).