N-(2-ethylcyclopropyl)thian-4-amine

C10H19NS — CID 103670014

IUPACN-(2-ethylcyclopropyl)thian-4-amine
SMILESCCC1CC1NC1CCSCC1
InChIInChI=1S/C10H19NS/c1-2-8-7-10(8)11-9-3-5-12-6-4-9/h8-11H,2-7H2,1H3
InChIKeyRUQUFCCEHBHXST-UHFFFAOYSA-N
MW185.34 g/mol
LogP2.27
Rot. Bonds3

About N-(2-ethylcyclopropyl)thian-4-amine

N-(2-ethylcyclopropyl)thian-4-amine (PubChem CID 103670014) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is N-(2-ethylcyclopropyl)thian-4-amine.

Molecular Properties

Compound NameN-(2-ethylcyclopropyl)thian-4-amine
PubChem CID103670014
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC NameN-(2-ethylcyclopropyl)thian-4-amine
SMILESCCC1CC1NC1CCSCC1
InChIInChI=1S/C10H19NS/c1-2-8-7-10(8)11-9-3-5-12-6-4-9/h8-11H,2-7H2,1H3
InChIKeyRUQUFCCEHBHXST-UHFFFAOYSA-N
XLogP2.27
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 ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylcyclopropyl)thiolan-3-amine
CID 103783743
N-(2-ethylcyclopropyl)cyclooctanamine
CID 103783809
3-cyclopropyl-N-(2-ethylcyclopropyl)cyclohexan-1-amine
CID 103783850
2-ethyl-N-(thiolan-3-ylmethyl)cyclopropan-1-amine
CID 107166344
N-(2-ethylsulfanylcyclohexyl)thian-4-amine
CID 115727021
2-ethyl-N-(2-ethylcyclopropyl)cyclohexan-1-amine
CID 103960948
N-[(1R,2R)-2-methylcyclopropyl]thiolan-3-amine
CID 131110851
N-(2,3-dimethylcyclohexyl)thian-4-amine
CID 43394865
N-(2-ethylcyclopentyl)thian-3-amine
CID 115726681
1-ethyl-4-(thian-4-ylamino)cyclohexan-1-ol
CID 115888197
4-propan-2-yl-N-(2-propylcyclopropyl)cycloheptan-1-amine
CID 114110275
N-(2-ethylcyclopropyl)-1-oxaspiro[5.5]undecan-4-amine
CID 114108180

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclopropyl)thian-4-amine?
The IUPAC name of N-(2-ethylcyclopropyl)thian-4-amine (CID 103670014) is N-(2-ethylcyclopropyl)thian-4-amine.
What is the SMILES notation for N-(2-ethylcyclopropyl)thian-4-amine?
The canonical SMILES for N-(2-ethylcyclopropyl)thian-4-amine is CCC1CC1NC1CCSCC1.
What is the InChIKey of N-(2-ethylcyclopropyl)thian-4-amine?
The InChIKey is RUQUFCCEHBHXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-2-8-7-10(8)11-9-3-5-12-6-4-9/h8-11H,2-7H2,1H3.
What are the key properties of N-(2-ethylcyclopropyl)thian-4-amine?
N-(2-ethylcyclopropyl)thian-4-amine has a molecular weight of 185.34 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclopropyl)thian-4-amine is sourced from PubChem (CID 103670014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).