2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine

C10H19NS — CID 102671571

IUPAC2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine
SMILESCC1CC1CNC1CCSC1C
InChIInChI=1S/C10H19NS/c1-7-5-9(7)6-11-10-3-4-12-8(10)2/h7-11H,3-6H2,1-2H3
InChIKeySLWPUSDGNCIMJD-UHFFFAOYSA-N
MW185.34 g/mol
LogP2.13
Rot. Bonds3

About 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine

2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine (PubChem CID 102671571) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine
PubChem CID102671571
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine
SMILESCC1CC1CNC1CCSC1C
InChIInChI=1S/C10H19NS/c1-7-5-9(7)6-11-10-3-4-12-8(10)2/h7-11H,3-6H2,1-2H3
InChIKeySLWPUSDGNCIMJD-UHFFFAOYSA-N
XLogP2.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(thian-2-ylmethyl)thiolan-3-amine
CID 102672978
2-[[(2-methylthian-3-yl)amino]methyl]cyclohexan-1-ol
CID 79957776
trans-(1R,2R)-2-[(2-methylcyclopropyl)methylamino]cyclopentan-1-ol
CID 102734052
2-methyl-N-(3-methylbut-2-enyl)thiolan-3-amine
CID 103529246
N'-methyl-N-(2-methylthiolan-3-yl)-N'-propan-2-ylethane-1,2-diamine
CID 102671868
N-[2-(azepan-1-yl)ethyl]-2-methylthiolan-3-amine
CID 102671482
2-methyl-N-(2-methylsulfinylethyl)thiolan-3-amine
CID 102672329
N-[(1-ethylcyclopropyl)methyl]-2-methylthiolan-3-amine
CID 102672499
N',N'-dimethyl-N-(2-methylthiolan-3-yl)butane-1,4-diamine
CID 102671776
N-[(2-methylcyclopropyl)methyl]bicyclo[4.1.0]heptan-2-amine
CID 130525526
N',N'-diethyl-N-(2-methylthiolan-3-yl)propane-1,3-diamine
CID 102672813
2-methyl-N-[(4-methylphenyl)methyl]thiolan-3-amine
CID 102671342

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine?
The IUPAC name of 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine (CID 102671571) is 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine.
What is the SMILES notation for 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine?
The canonical SMILES for 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine is CC1CC1CNC1CCSC1C.
What is the InChIKey of 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine?
The InChIKey is SLWPUSDGNCIMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-7-5-9(7)6-11-10-3-4-12-8(10)2/h7-11H,3-6H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine?
2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine has a molecular weight of 185.34 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylcyclopropyl)methyl]thiolan-3-amine is sourced from PubChem (CID 102671571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).