N-propan-2-ylthiomorpholin-2-amine

C7H16N2S — CID 173143997

IUPACN-propan-2-ylthiomorpholin-2-amine
SMILESCC(C)NC1CNCCS1
InChIInChI=1S/C7H16N2S/c1-6(2)9-7-5-8-3-4-10-7/h6-9H,3-5H2,1-2H3
InChIKeyHICQSAJWWUNXFY-UHFFFAOYSA-N
MW160.29 g/mol
LogP0.65
Rot. Bonds2

About N-propan-2-ylthiomorpholin-2-amine

N-propan-2-ylthiomorpholin-2-amine (PubChem CID 173143997) has the molecular formula C7H16N2S and a molecular weight of 160.29 g/mol. Its IUPAC name is N-propan-2-ylthiomorpholin-2-amine.

Molecular Properties

Compound NameN-propan-2-ylthiomorpholin-2-amine
PubChem CID173143997
Molecular FormulaC7H16N2S
Molecular Weight160.29 g/mol
Exact Mass160.10
IUPAC NameN-propan-2-ylthiomorpholin-2-amine
SMILESCC(C)NC1CNCCS1
InChIInChI=1S/C7H16N2S/c1-6(2)9-7-5-8-3-4-10-7/h6-9H,3-5H2,1-2H3
InChIKeyHICQSAJWWUNXFY-UHFFFAOYSA-N
XLogP0.65
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.29
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-heptan-4-ylthiomorpholin-2-amine
CID 173143895
2-thiomorpholin-2-ylpropan-2-ol
CID 83618265
2-methylthiomorpholine
CID 14953857
(3R)-N-propan-2-ylpyrrolidin-3-amine
CID 53346611
N-propan-2-ylpiperazin-2-amine
CID 90744079
N-(1-amino-1-oxopropan-2-yl)thiomorpholine-2-carboxamide
CID 164653765
molecular hydrogen;(3S)-N-propan-2-ylpiperidin-3-amine
CID 164555639
thiomorpholin-2-yl thiohypochlorite
CID 154410723
2-ethylthiomorpholine
CID 21495166
(3S,4R)-4-fluoro-N-propan-2-ylpiperidin-3-amine
CID 164821452
3-fluoro-N-propan-2-ylpiperidin-4-amine
CID 59304222
3-piperidin-3-yl-1-thiomorpholin-4-ylbutan-1-one
CID 81043728

Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylthiomorpholin-2-amine?
The IUPAC name of N-propan-2-ylthiomorpholin-2-amine (CID 173143997) is N-propan-2-ylthiomorpholin-2-amine.
What is the SMILES notation for N-propan-2-ylthiomorpholin-2-amine?
The canonical SMILES for N-propan-2-ylthiomorpholin-2-amine is CC(C)NC1CNCCS1.
What is the InChIKey of N-propan-2-ylthiomorpholin-2-amine?
The InChIKey is HICQSAJWWUNXFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2S/c1-6(2)9-7-5-8-3-4-10-7/h6-9H,3-5H2,1-2H3.
What are the key properties of N-propan-2-ylthiomorpholin-2-amine?
N-propan-2-ylthiomorpholin-2-amine has a molecular weight of 160.29 g/mol, XLogP of 0.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylthiomorpholin-2-amine is sourced from PubChem (CID 173143997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).