N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide

C17H30N2O — CID 78897689

IUPACN-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCN(CC(=O)N(C2CCCC2)C2CC2)C1
InChIInChI=1S/C17H30N2O/c1-2-14-6-5-11-18(12-14)13-17(20)19(16-9-10-16)15-7-3-4-8-15/h14-16H,2-13H2,1H3
InChIKeyPAGOFQRHDDLCOU-UHFFFAOYSA-N
MW278.44 g/mol
LogP3.04
Rot. Bonds5

About N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide

N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide (PubChem CID 78897689) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide
PubChem CID78897689
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC NameN-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCN(CC(=O)N(C2CCCC2)C2CC2)C1
InChIInChI=1S/C17H30N2O/c1-2-14-6-5-11-18(12-14)13-17(20)19(16-9-10-16)15-7-3-4-8-15/h14-16H,2-13H2,1H3
InChIKeyPAGOFQRHDDLCOU-UHFFFAOYSA-N
XLogP3.04
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide?
The IUPAC name of N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide (CID 78897689) is N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide?
The canonical SMILES for N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide is CCC1CCCN(CC(=O)N(C2CCCC2)C2CC2)C1.
What is the InChIKey of N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide?
The InChIKey is PAGOFQRHDDLCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-2-14-6-5-11-18(12-14)13-17(20)19(16-9-10-16)15-7-3-4-8-15/h14-16H,2-13H2,1H3.
What are the key properties of N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide?
N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide has a molecular weight of 278.44 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide is sourced from PubChem (CID 78897689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).