2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide

C14H25F3N2O — CID 64678939

IUPAC2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCC(CC)N(CC(F)(F)F)C(=O)CC1(N)CCCC1
InChIInChI=1S/C14H25F3N2O/c1-3-11(4-2)19(10-14(15,16)17)12(20)9-13(18)7-5-6-8-13/h11H,3-10,18H2,1-2H3
InChIKeyGAPCAPJNPUSUON-UHFFFAOYSA-N
MW294.36 g/mol
LogP3.23
Rot. Bonds6

About 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide

2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 64678939) has the molecular formula C14H25F3N2O and a molecular weight of 294.36 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID64678939
Molecular FormulaC14H25F3N2O
Molecular Weight294.36 g/mol
Exact Mass294.19
IUPAC Name2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCC(CC)N(CC(F)(F)F)C(=O)CC1(N)CCCC1
InChIInChI=1S/C14H25F3N2O/c1-3-11(4-2)19(10-14(15,16)17)12(20)9-13(18)7-5-6-8-13/h11H,3-10,18H2,1-2H3
InChIKeyGAPCAPJNPUSUON-UHFFFAOYSA-N
XLogP3.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 64678939) is 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide is CCC(CC)N(CC(F)(F)F)C(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is GAPCAPJNPUSUON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O/c1-3-11(4-2)19(10-14(15,16)17)12(20)9-13(18)7-5-6-8-13/h11H,3-10,18H2,1-2H3.
What are the key properties of 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 294.36 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 64678939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).