N-(2-ethylcyclopropyl)thiolan-3-amine

C9H17NS — CID 103783743

IUPACN-(2-ethylcyclopropyl)thiolan-3-amine
SMILESCCC1CC1NC1CCSC1
InChIInChI=1S/C9H17NS/c1-2-7-5-9(7)10-8-3-4-11-6-8/h7-10H,2-6H2,1H3
InChIKeyUTWCQTKWZHDVJY-UHFFFAOYSA-N
MW171.31 g/mol
LogP1.88
Rot. Bonds3

About N-(2-ethylcyclopropyl)thiolan-3-amine

N-(2-ethylcyclopropyl)thiolan-3-amine (PubChem CID 103783743) has the molecular formula C9H17NS and a molecular weight of 171.31 g/mol. Its IUPAC name is N-(2-ethylcyclopropyl)thiolan-3-amine.

Molecular Properties

Compound NameN-(2-ethylcyclopropyl)thiolan-3-amine
PubChem CID103783743
Molecular FormulaC9H17NS
Molecular Weight171.31 g/mol
Exact Mass171.11
IUPAC NameN-(2-ethylcyclopropyl)thiolan-3-amine
SMILESCCC1CC1NC1CCSC1
InChIInChI=1S/C9H17NS/c1-2-7-5-9(7)10-8-3-4-11-6-8/h7-10H,2-6H2,1H3
InChIKeyUTWCQTKWZHDVJY-UHFFFAOYSA-N
XLogP1.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylcyclopropyl)thian-4-amine
CID 103670014
N-[(1R,2R)-2-methylcyclopropyl]thiolan-3-amine
CID 131110851
N-(2-ethylcyclopentyl)thian-3-amine
CID 115726681
N-(2-ethylcyclopropyl)cyclooctanamine
CID 103783809
2-ethyl-N-(thiolan-3-ylmethyl)cyclopropan-1-amine
CID 107166344
N-(2-methylcyclopentyl)thiolan-3-amine
CID 63277405
[2-(thiolan-3-ylamino)cyclohexyl]methanol
CID 103784945
N-[2-(aminomethyl)cyclopentyl]thiolan-3-amine
CID 103062677
3-cyclopropyl-N-(2-ethylcyclopropyl)cyclohexan-1-amine
CID 103783850
N-(4-butylcyclohexyl)thiolan-3-amine
CID 115713977
2-ethyl-N-(2-ethylcyclopropyl)cyclohexan-1-amine
CID 103960948
trans-(1R,2R)-2-(thiolan-3-ylamino)cyclohexan-1-ol
CID 104926602

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclopropyl)thiolan-3-amine?
The IUPAC name of N-(2-ethylcyclopropyl)thiolan-3-amine (CID 103783743) is N-(2-ethylcyclopropyl)thiolan-3-amine.
What is the SMILES notation for N-(2-ethylcyclopropyl)thiolan-3-amine?
The canonical SMILES for N-(2-ethylcyclopropyl)thiolan-3-amine is CCC1CC1NC1CCSC1.
What is the InChIKey of N-(2-ethylcyclopropyl)thiolan-3-amine?
The InChIKey is UTWCQTKWZHDVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NS/c1-2-7-5-9(7)10-8-3-4-11-6-8/h7-10H,2-6H2,1H3.
What are the key properties of N-(2-ethylcyclopropyl)thiolan-3-amine?
N-(2-ethylcyclopropyl)thiolan-3-amine has a molecular weight of 171.31 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclopropyl)thiolan-3-amine is sourced from PubChem (CID 103783743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).