N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide

C10H17F3N2O2 — CID 103774470

IUPACN-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)NC1CCCC1CO
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)6-14-4-9(17)15-8-3-1-2-7(8)5-16/h7-8,14,16H,1-6H2,(H,15,17)
InChIKeyMZJNWVLFTFAXND-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.42
Rot. Bonds5

About N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 103774470) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID103774470
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)NC1CCCC1CO
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)6-14-4-9(17)15-8-3-1-2-7(8)5-16/h7-8,14,16H,1-6H2,(H,15,17)
InChIKeyMZJNWVLFTFAXND-UHFFFAOYSA-N
XLogP0.42
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-(hydroxymethyl)cyclopentyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 55082339
2-[(2-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 65838650
2-[[2-(hydroxymethyl)cyclopentyl]methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 65926878
N-[(2-hydroxycyclopentyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 79036742
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 79260931
N-[1-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 79261785
2-amino-3,3,3-trifluoro-N-[(2-hydroxycyclopentyl)methyl]-2-methylpropanamide
CID 79810595
3-(2,2-difluoroethoxy)-N-[2-(hydroxymethyl)cyclopentyl]propanamide
CID 103525061
N-[2-(hydroxymethyl)cyclopentyl]-3-(2,2,2-trifluoroethoxy)propanamide
CID 103751211
3,3,3-trifluoro-N-[2-(hydroxymethyl)cyclopentyl]propanamide
CID 103773978
4,4,4-trifluoro-N-[2-(hydroxymethyl)cyclopentyl]butanamide
CID 103774019
2,2,3,3-tetrafluoro-N-[2-(hydroxymethyl)cyclopentyl]propanamide
CID 103774273

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 103774470) is N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide is O=C(CNCC(F)(F)F)NC1CCCC1CO.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is MZJNWVLFTFAXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c11-10(12,13)6-14-4-9(17)15-8-3-1-2-7(8)5-16/h7-8,14,16H,1-6H2,(H,15,17).
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 254.25 g/mol, XLogP of 0.42, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 103774470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).