1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol

C11H21F3N2O — CID 103366483

IUPAC1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol
SMILESCN(CC(CN)C(F)(F)F)CC1(O)CCCC1
InChIInChI=1S/C11H21F3N2O/c1-16(7-9(6-15)11(12,13)14)8-10(17)4-2-3-5-10/h9,17H,2-8,15H2,1H3
InChIKeyFJBQRBGPWRVMCN-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.36
Rot. Bonds5

About 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol

1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol (PubChem CID 103366483) has the molecular formula C11H21F3N2O and a molecular weight of 254.30 g/mol. Its IUPAC name is 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol
PubChem CID103366483
Molecular FormulaC11H21F3N2O
Molecular Weight254.30 g/mol
Exact Mass254.16
IUPAC Name1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol
SMILESCN(CC(CN)C(F)(F)F)CC1(O)CCCC1
InChIInChI=1S/C11H21F3N2O/c1-16(7-9(6-15)11(12,13)14)8-10(17)4-2-3-5-10/h9,17H,2-8,15H2,1H3
InChIKeyFJBQRBGPWRVMCN-UHFFFAOYSA-N
XLogP1.36
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 65105930
1-[(3,3,3-Trifluoropropylamino)methyl]cyclopentan-1-ol
CID 65108895
1-{[(2,2,2-Trifluoroethyl)amino]methyl}cyclopentan-1-ol
CID 65108996
1-[(2,2-Difluoroethylamino)methyl]cyclopentan-1-ol
CID 65109046
1-[[Ethyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 65212677
1-[[Propyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 65212733
1-[[Methyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 65213211
1-[[Methyl(3,3,3-trifluoropropyl)amino]methyl]cyclopentan-1-ol
CID 65539069
1-[(2-Fluoroethylamino)methyl]cyclopentan-1-ol
CID 80694379
1-[(3-Fluoropropylamino)methyl]cyclopentan-1-ol
CID 81107322
1-[(1,1-Difluoropropan-2-ylamino)methyl]cyclopentan-1-ol
CID 102869656
3,3,3-Trifluoro-2-[[(1-hydroxycyclopentyl)methylamino]methyl]propanenitrile
CID 103367341

Frequently Asked Questions

What is the IUPAC name of 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol (CID 103366483) is 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol is CN(CC(CN)C(F)(F)F)CC1(O)CCCC1.
What is the InChIKey of 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol?
The InChIKey is FJBQRBGPWRVMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O/c1-16(7-9(6-15)11(12,13)14)8-10(17)4-2-3-5-10/h9,17H,2-8,15H2,1H3.
What are the key properties of 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol?
1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol has a molecular weight of 254.30 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[2-(aminomethyl)-3,3,3-trifluoropropyl]-methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103366483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).