(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine

C12H22F2N2 — CID 146477426

IUPAC(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine
SMILESCC(C)N1CCC2(CC1)CCC(F)(F)[C@H]2N
InChIInChI=1S/C12H22F2N2/c1-9(2)16-7-5-11(6-8-16)3-4-12(13,14)10(11)15/h9-10H,3-8,15H2,1-2H3/t10-/m0/s1
InChIKeyUNWNCZGBQSTINM-JTQLQIEISA-N
MW232.32 g/mol
LogP2.23
Rot. Bonds1

About (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine

(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine (PubChem CID 146477426) has the molecular formula C12H22F2N2 and a molecular weight of 232.32 g/mol. Its IUPAC name is (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine
PubChem CID146477426
Molecular FormulaC12H22F2N2
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine
SMILESCC(C)N1CCC2(CC1)CCC(F)(F)[C@H]2N
InChIInChI=1S/C12H22F2N2/c1-9(2)16-7-5-11(6-8-16)3-4-12(13,14)10(11)15/h9-10H,3-8,15H2,1-2H3/t10-/m0/s1
InChIKeyUNWNCZGBQSTINM-JTQLQIEISA-N
XLogP2.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4S)-3-fluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine
CID 146477423
3-propan-2-yl-3-azaspiro[5.5]undecan-9-amine
CID 171508943
(8R)-7,7-difluorospiro[2.5]octan-8-amine
CID 162559331
(4R)-3,3-difluoro-8-azaspiro[4.5]decan-4-amine
CID 167210135
9-methyl-6-propan-2-yl-6-azaspiro[2.6]nonane
CID 156876196
3,9-di(propan-2-yl)-3-azaspiro[5.5]undecane;ethane
CID 154680928
4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide
CID 126737674
(2R)-2-methyl-7-propan-2-yl-7-azaspiro[2.6]nonane
CID 118287814
(3S,4S)-3-ethyl-8-propan-2-yl-2-oxa-8-azaspiro[4.5]decan-4-amine
CID 146477418
8-propan-2-yl-8-azaspiro[4.5]deca-1,3-diene
CID 162769943
1,4-di(propan-2-yl)piperidin-4-amine
CID 167417701
4-iodo-1-propan-2-ylpiperidin-4-amine
CID 155455763

Frequently Asked Questions

What is the IUPAC name of (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine (CID 146477426) is (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine is CC(C)N1CCC2(CC1)CCC(F)(F)[C@H]2N.
What is the InChIKey of (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine?
The InChIKey is UNWNCZGBQSTINM-JTQLQIEISA-N. The full InChI is InChI=1S/C12H22F2N2/c1-9(2)16-7-5-11(6-8-16)3-4-12(13,14)10(11)15/h9-10H,3-8,15H2,1-2H3/t10-/m0/s1.
What are the key properties of (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine?
(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine has a molecular weight of 232.32 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 146477426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).