1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide

C14H24F3N3O — CID 79646385

IUPAC1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
SMILESCCCN(CC(F)(F)F)C1CCC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C14H24F3N3O/c1-2-7-20(9-14(15,16)17)11-5-6-13(8-11,12(18)21)19-10-3-4-10/h10-11,19H,2-9H2,1H3,(H2,18,21)
InChIKeyOYIFUYFIFQWFHA-UHFFFAOYSA-N
MW307.36 g/mol
LogP1.79
Rot. Bonds7

About 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide

1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide (PubChem CID 79646385) has the molecular formula C14H24F3N3O and a molecular weight of 307.36 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
PubChem CID79646385
Molecular FormulaC14H24F3N3O
Molecular Weight307.36 g/mol
Exact Mass307.19
IUPAC Name1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
SMILESCCCN(CC(F)(F)F)C1CCC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C14H24F3N3O/c1-2-7-20(9-14(15,16)17)11-5-6-13(8-11,12(18)21)19-10-3-4-10/h10-11,19H,2-9H2,1H3,(H2,18,21)
InChIKeyOYIFUYFIFQWFHA-UHFFFAOYSA-N
XLogP1.79
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(propan-2-ylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
CID 79646380
1-(cyclopropylamino)-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
CID 79646367
[1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclohexyl]methanol
CID 79634544
methyl 1-(cyclopropylamino)-3-(dipropylamino)cyclopentane-1-carboxylate
CID 79650666
3-(dipropylamino)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79650183
3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclohexane-1-carboxamide
CID 79636571
1-(ethylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclohexane-1-carboxylic acid
CID 79626795
1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide
CID 79655102
3-[cyclopentyl(ethyl)amino]-1-(cyclopropylamino)cyclopentane-1-carboxamide
CID 79655119
[1-(propylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentyl]methanol
CID 79656540
3-(dipropylamino)-1-(propylamino)cyclohexane-1-carboxamide
CID 79636670
3-butylsulfanyl-1-(cyclopropylamino)cyclopentane-1-carboxamide
CID 79653743

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide (CID 79646385) is 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide is CCCN(CC(F)(F)F)C1CCC(NC2CC2)(C(N)=O)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide?
The InChIKey is OYIFUYFIFQWFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3N3O/c1-2-7-20(9-14(15,16)17)11-5-6-13(8-11,12(18)21)19-10-3-4-10/h10-11,19H,2-9H2,1H3,(H2,18,21).
What are the key properties of 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide?
1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide has a molecular weight of 307.36 g/mol, XLogP of 1.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide is sourced from PubChem (CID 79646385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).