(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine

C10H16N2S — CID 93316384

IUPAC(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
SMILESC[C@@H](c1cccs1)N1CC[C@H](N)C1
InChIInChI=1S/C10H16N2S/c1-8(10-3-2-6-13-10)12-5-4-9(11)7-12/h2-3,6,8-9H,4-5,7,11H2,1H3/t8-,9-/m0/s1
InChIKeyAUIPUHZQNODGTN-IUCAKERBSA-N
MW196.32 g/mol
LogP1.84
Rot. Bonds2

About (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine

(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine (PubChem CID 93316384) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
PubChem CID93316384
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
SMILESC[C@@H](c1cccs1)N1CC[C@H](N)C1
InChIInChI=1S/C10H16N2S/c1-8(10-3-2-6-13-10)12-5-4-9(11)7-12/h2-3,6,8-9H,4-5,7,11H2,1H3/t8-,9-/m0/s1
InChIKeyAUIPUHZQNODGTN-IUCAKERBSA-N
XLogP1.84
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-1-[(1S)-1-thiophen-2-ylethyl]piperidin-3-yl]methanol
CID 98084280
[1-[(1S)-1-thiophen-2-ylethyl]piperidin-4-yl]methanol
CID 97175553
1-[1-(5-ethylthiophen-2-yl)ethyl]pyrrolidin-3-amine
CID 62069492
N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride
CID 71642773
1-[1-(furan-2-yl)ethyl]pyrrolidin-3-amine
CID 43535712
8-(1-thiophen-2-ylethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61233082
(3S)-1-[1-(1,3-thiazol-2-yl)ethyl]pyrrolidin-3-amine;hydrochloride
CID 71637692
1,3,5-tris(1-thiophen-2-ylethyl)-1,3,5-triazinane
CID 68714918
(3S)-1-[1-(1H-pyrrol-2-yl)ethyl]pyrrolidin-3-amine;hydrochloride
CID 71637682
1-[1-(4-chlorophenyl)ethyl]pyrrolidin-3-amine;hydrochloride
CID 119917726
3-[1-(3-aminopyrrolidin-1-yl)ethyl]phenol
CID 62068559
1-[1-(5-chlorothiophen-2-yl)ethyl]piperidin-3-amine
CID 61297752

Frequently Asked Questions

What is the IUPAC name of (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
The IUPAC name of (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine (CID 93316384) is (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine.
What is the SMILES notation for (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
The canonical SMILES for (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine is C[C@@H](c1cccs1)N1CC[C@H](N)C1.
What is the InChIKey of (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
The InChIKey is AUIPUHZQNODGTN-IUCAKERBSA-N. The full InChI is InChI=1S/C10H16N2S/c1-8(10-3-2-6-13-10)12-5-4-9(11)7-12/h2-3,6,8-9H,4-5,7,11H2,1H3/t8-,9-/m0/s1.
What are the key properties of (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine has a molecular weight of 196.32 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine is sourced from PubChem (CID 93316384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).