2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide

C12H21F3N2O — CID 56783908

IUPAC2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(=O)NCC(F)(F)F)C1CCCC1
InChIInChI=1S/C12H21F3N2O/c1-9(2)17(10-5-3-4-6-10)7-11(18)16-8-12(13,14)15/h9-10H,3-8H2,1-2H3,(H,16,18)
InChIKeyZYXWWXLTLVPFHP-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.32
Rot. Bonds5

About 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 56783908) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID56783908
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC Name2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(=O)NCC(F)(F)F)C1CCCC1
InChIInChI=1S/C12H21F3N2O/c1-9(2)17(10-5-3-4-6-10)7-11(18)16-8-12(13,14)15/h9-10H,3-8H2,1-2H3,(H,16,18)
InChIKeyZYXWWXLTLVPFHP-UHFFFAOYSA-N
XLogP2.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 56783908) is 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide is CC(C)N(CC(=O)NCC(F)(F)F)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is ZYXWWXLTLVPFHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c1-9(2)17(10-5-3-4-6-10)7-11(18)16-8-12(13,14)15/h9-10H,3-8H2,1-2H3,(H,16,18).
What are the key properties of 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 266.31 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 56783908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).