2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine

C10H20N2S — CID 66993394

IUPAC2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine
SMILESCC1SC2(CCN(C)CC2)CC1N
InChIInChI=1S/C10H20N2S/c1-8-9(11)7-10(13-8)3-5-12(2)6-4-10/h8-9H,3-7,11H2,1-2H3
InChIKeyLQFIBMFRXDADPN-UHFFFAOYSA-N
MW200.35 g/mol
LogP1.30
Rot. Bonds

About 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine

2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine (PubChem CID 66993394) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine.

Molecular Properties

Compound Name2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine
PubChem CID66993394
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC Name2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine
SMILESCC1SC2(CCN(C)CC2)CC1N
InChIInChI=1S/C10H20N2S/c1-8-9(11)7-10(13-8)3-5-12(2)6-4-10/h8-9H,3-7,11H2,1-2H3
InChIKeyLQFIBMFRXDADPN-UHFFFAOYSA-N
XLogP1.30
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluoropiperidin-4-yl)methyl]thiolan-3-amine
CID 105473222
1-[(3-Fluorothiolan-3-yl)methyl]piperidin-4-amine
CID 126845982
6,7-Dimethyl-1,4-dithia-8-aza-spiro[4.5]decane
CID 6420750
2,8-Dimethyl-1-thia-8-azaspiro[4.5]decane
CID 58516172
2,8-Dimethyl-1-thia-3,8-diazaspiro[4.5]decane
CID 66993962
2-Thia-6-azaspiro[4.5]decane
CID 82415825
4-Methyl-1-thia-8-azaspiro[4.5]decane
CID 91551256
1-Thia-9-azaspiro[4.5]decane
CID 118210661
3-(2-Methylbutyl)thiomorpholine
CID 123288407
8-Methyl-1-thia-8-azaspiro[4.5]decan-4-amine
CID 135228318
3-(2-Methylpentan-2-yl)thiomorpholine
CID 139332273
4-[2-[1-(3-Methylbutyl)pyrrolidin-3-yl]sulfanylpropyl]piperidine
CID 146600177

Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine?
The IUPAC name of 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine (CID 66993394) is 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine.
What is the SMILES notation for 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine?
The canonical SMILES for 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine is CC1SC2(CCN(C)CC2)CC1N.
What is the InChIKey of 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine?
The InChIKey is LQFIBMFRXDADPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-8-9(11)7-10(13-8)3-5-12(2)6-4-10/h8-9H,3-7,11H2,1-2H3.
What are the key properties of 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine?
2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine has a molecular weight of 200.35 g/mol, XLogP of 1.30, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-1-thia-8-azaspiro[4.5]decan-3-amine is sourced from PubChem (CID 66993394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).