1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol

C14H26F2N2O — CID 83993144

IUPAC1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol
SMILESCC(O)C1CC(NCC(F)F)CN(C2CCCC2)C1
InChIInChI=1S/C14H26F2N2O/c1-10(19)11-6-12(17-7-14(15)16)9-18(8-11)13-4-2-3-5-13/h10-14,17,19H,2-9H2,1H3
InChIKeyBKZVDJRKXIKKCV-UHFFFAOYSA-N
MW276.37 g/mol
LogP1.86
Rot. Bonds5

About 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol

1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol (PubChem CID 83993144) has the molecular formula C14H26F2N2O and a molecular weight of 276.37 g/mol. Its IUPAC name is 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol
PubChem CID83993144
Molecular FormulaC14H26F2N2O
Molecular Weight276.37 g/mol
Exact Mass276.20
IUPAC Name1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol
SMILESCC(O)C1CC(NCC(F)F)CN(C2CCCC2)C1
InChIInChI=1S/C14H26F2N2O/c1-10(19)11-6-12(17-7-14(15)16)9-18(8-11)13-4-2-3-5-13/h10-14,17,19H,2-9H2,1H3
InChIKeyBKZVDJRKXIKKCV-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(3-Amino-1,1,1-trifluoropropan-2-yl)piperidin-3-yl]methanol
CID 43752760
[1-(3-Amino-1,1,1-trifluorobutan-2-yl)piperidin-3-yl]methanol
CID 61647651
[1-(3-Amino-1,1,1-trifluoropentan-2-yl)piperidin-3-yl]methanol
CID 61647652
3-(Methylamino)-4-[4-(trifluoromethyl)piperidin-1-yl]butan-1-ol
CID 65533676
3-(Ethylamino)-4-[3-(trifluoromethyl)piperidin-1-yl]butan-1-ol
CID 65534461
3-(Methylamino)-4-[3-(trifluoromethyl)piperidin-1-yl]butan-1-ol
CID 65534647
3-(Propylamino)-4-[3-(trifluoromethyl)piperidin-1-yl]butan-1-ol
CID 65535228
3-(Ethylamino)-4-[4-(trifluoromethyl)piperidin-1-yl]butan-1-ol
CID 65535822
3-(Propylamino)-4-[4-(trifluoromethyl)piperidin-1-yl]butan-1-ol
CID 65536223
2-[[[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 65834609
2-[1-Methyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]ethanol
CID 83992066
3-[1-Methyl-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]propan-1-ol
CID 83992073

Frequently Asked Questions

What is the IUPAC name of 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol?
The IUPAC name of 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol (CID 83993144) is 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol.
What is the SMILES notation for 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol?
The canonical SMILES for 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol is CC(O)C1CC(NCC(F)F)CN(C2CCCC2)C1.
What is the InChIKey of 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol?
The InChIKey is BKZVDJRKXIKKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F2N2O/c1-10(19)11-6-12(17-7-14(15)16)9-18(8-11)13-4-2-3-5-13/h10-14,17,19H,2-9H2,1H3.
What are the key properties of 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol?
1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol has a molecular weight of 276.37 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol is sourced from PubChem (CID 83993144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).