[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine

C10H16N2S — CID 62068989

IUPAC[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCN(Cc2ccsc2)C1
InChIInChI=1S/C10H16N2S/c11-5-9-1-3-12(6-9)7-10-2-4-13-8-10/h2,4,8-9H,1,3,5-7,11H2
InChIKeyUETYSGDEFLAFKV-UHFFFAOYSA-N
MW196.32 g/mol
LogP1.53
Rot. Bonds3

About [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine

[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine (PubChem CID 62068989) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine
PubChem CID62068989
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCN(Cc2ccsc2)C1
InChIInChI=1S/C10H16N2S/c11-5-9-1-3-12(6-9)7-10-2-4-13-8-10/h2,4,8-9H,1,3,5-7,11H2
InChIKeyUETYSGDEFLAFKV-UHFFFAOYSA-N
XLogP1.53
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
CID 129367813
3-bromo-1-(thiophen-3-ylmethyl)pyrrolidine
CID 80675822
1-(thiophen-3-ylmethyl)pyrrolidin-3-ol
CID 62916311
2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol
CID 121200335
4-(bromomethyl)-1-(thiophen-3-ylmethyl)azepane
CID 131162358
3-[[3-(aminomethyl)pyrrolidin-1-yl]methyl]phenol
CID 62069269
(3S)-3-(4-fluorophenyl)-1-(thiophen-3-ylmethyl)pyrrolidine
CID 95869700
(3aS,7aS)-5-(cyclopropylmethyl)-2-(thiophen-3-ylmethyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridine
CID 97377225
[1-[(4-trimethylsilylphenyl)methyl]pyrrolidin-3-yl]methanamine
CID 103438151
1-(thiophen-3-ylmethyl)azetidine
CID 131087701
[1-[(3,4,5-trifluorophenyl)methyl]pyrrolidin-3-yl]methanamine
CID 55146596
[1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-3-yl]methanamine
CID 62068987

Frequently Asked Questions

What is the IUPAC name of [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine (CID 62068989) is [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine is NCC1CCN(Cc2ccsc2)C1.
What is the InChIKey of [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine?
The InChIKey is UETYSGDEFLAFKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c11-5-9-1-3-12(6-9)7-10-2-4-13-8-10/h2,4,8-9H,1,3,5-7,11H2.
What are the key properties of [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine?
[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine has a molecular weight of 196.32 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 62068989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).