2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide

C14H29N3O — CID 81460274

IUPAC2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide
SMILESCCC1CN(C(C)C(=O)NCC(C)C)CCC1N
InChIInChI=1S/C14H29N3O/c1-5-12-9-17(7-6-13(12)15)11(4)14(18)16-8-10(2)3/h10-13H,5-9,15H2,1-4H3,(H,16,18)
InChIKeyLUPYOLNCSQCFON-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.21
Rot. Bonds5

About 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide

2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide (PubChem CID 81460274) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide
PubChem CID81460274
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide
SMILESCCC1CN(C(C)C(=O)NCC(C)C)CCC1N
InChIInChI=1S/C14H29N3O/c1-5-12-9-17(7-6-13(12)15)11(4)14(18)16-8-10(2)3/h10-13H,5-9,15H2,1-4H3,(H,16,18)
InChIKeyLUPYOLNCSQCFON-UHFFFAOYSA-N
XLogP1.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide (CID 81460274) is 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide is CCC1CN(C(C)C(=O)NCC(C)C)CCC1N.
What is the InChIKey of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide?
The InChIKey is LUPYOLNCSQCFON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-12-9-17(7-6-13(12)15)11(4)14(18)16-8-10(2)3/h10-13H,5-9,15H2,1-4H3,(H,16,18).
What are the key properties of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide?
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide has a molecular weight of 255.41 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 81460274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).