1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide

C10H16F3N3O2 — CID 119297008

IUPAC1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)NCC(=O)NCC(F)(F)F)CCCC1
InChIInChI=1S/C10H16F3N3O2/c11-10(12,13)6-16-7(17)5-15-8(18)9(14)3-1-2-4-9/h1-6,14H2,(H,15,18)(H,16,17)
InChIKeyVGBJNPVWVWUMKR-UHFFFAOYSA-N
MW267.25 g/mol
LogP0.05
Rot. Bonds4

About 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide

1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide (PubChem CID 119297008) has the molecular formula C10H16F3N3O2 and a molecular weight of 267.25 g/mol. Its IUPAC name is 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide
PubChem CID119297008
Molecular FormulaC10H16F3N3O2
Molecular Weight267.25 g/mol
Exact Mass267.12
IUPAC Name1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)NCC(=O)NCC(F)(F)F)CCCC1
InChIInChI=1S/C10H16F3N3O2/c11-10(12,13)6-16-7(17)5-15-8(18)9(14)3-1-2-4-9/h1-6,14H2,(H,15,18)(H,16,17)
InChIKeyVGBJNPVWVWUMKR-UHFFFAOYSA-N
XLogP0.05
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119291003
2-[[1-(hydroxymethyl)cyclopentyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 55082339
1-amino-N-[2-(tert-butylamino)-2-oxoethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119272923
1-amino-N-(2-bromo-2,2-difluoroethyl)cyclopentane-1-carboxamide
CID 130551943
1-amino-N-[2-(methylamino)-2-oxoethyl]cyclobutane-1-carboxamide
CID 81179179
1-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclohexane-1-carboxamide
CID 60946592
2-[[2-[(1-aminocyclopropanecarbonyl)amino]acetyl]amino]acetic acid
CID 65466641
1-amino-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119279337
1-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclobutane-1-carboxamide
CID 81172740
1-amino-N-(4,4,4-trifluorobutyl)cyclohexane-1-carboxamide;hydrochloride
CID 119322435
2-(chloroamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 118369505
2-[1-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclohexyl]acetic acid
CID 43235051

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide (CID 119297008) is 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide is NC1(C(=O)NCC(=O)NCC(F)(F)F)CCCC1.
What is the InChIKey of 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide?
The InChIKey is VGBJNPVWVWUMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N3O2/c11-10(12,13)6-16-7(17)5-15-8(18)9(14)3-1-2-4-9/h1-6,14H2,(H,15,18)(H,16,17).
What are the key properties of 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide?
1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide has a molecular weight of 267.25 g/mol, XLogP of 0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119297008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).