10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol

C14H25F2NO — CID 165490978

IUPAC10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol
SMILESCCN(CC(F)F)C1CC(O)CCC12CCCC2
InChIInChI=1S/C14H25F2NO/c1-2-17(10-13(15)16)12-9-11(18)5-8-14(12)6-3-4-7-14/h11-13,18H,2-10H2,1H3
InChIKeyNVAOWBAHJJMEAH-UHFFFAOYSA-N
MW261.36 g/mol
LogP3.05
Rot. Bonds4

About 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol

10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol (PubChem CID 165490978) has the molecular formula C14H25F2NO and a molecular weight of 261.36 g/mol. Its IUPAC name is 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol.

Molecular Properties

Compound Name10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol
PubChem CID165490978
Molecular FormulaC14H25F2NO
Molecular Weight261.36 g/mol
Exact Mass261.19
IUPAC Name10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol
SMILESCCN(CC(F)F)C1CC(O)CCC12CCCC2
InChIInChI=1S/C14H25F2NO/c1-2-17(10-13(15)16)12-9-11(18)5-8-14(12)6-3-4-7-14/h11-13,18H,2-10H2,1H3
InChIKeyNVAOWBAHJJMEAH-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[Tert-butyl(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490683
3-[Cyclopropyl(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490687
3-[Cyclopropyl(ethyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490688
3-[Methyl(2-methylpropyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490689
3-[Cyclopentyl(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490691
3-[Methyl(2-methylbutan-2-yl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490692
3-[(Propan-2-yl)(propyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490693
3-[(3-Methoxypropyl)(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490694
3-(4,4-Dimethylpiperidin-1-yl)-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490696
3-[Cyclopropyl(2-methylpropyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490697
3-[Tert-butyl(propyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490700
3-[(2,2-Difluoroethyl)(propyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490701

Frequently Asked Questions

What is the IUPAC name of 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol?
The IUPAC name of 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol (CID 165490978) is 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol.
What is the SMILES notation for 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol?
The canonical SMILES for 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol is CCN(CC(F)F)C1CC(O)CCC12CCCC2.
What is the InChIKey of 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol?
The InChIKey is NVAOWBAHJJMEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F2NO/c1-2-17(10-13(15)16)12-9-11(18)5-8-14(12)6-3-4-7-14/h11-13,18H,2-10H2,1H3.
What are the key properties of 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol?
10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol has a molecular weight of 261.36 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2,2-difluoroethyl(ethyl)amino]spiro[4.5]decan-8-ol is sourced from PubChem (CID 165490978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).