N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine

C15H26N2S — CID 54962549

IUPACN-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine
SMILESCCCNC1CCN(C(CCC)c2cccs2)C1
InChIInChI=1S/C15H26N2S/c1-3-6-14(15-7-5-11-18-15)17-10-8-13(12-17)16-9-4-2/h5,7,11,13-14,16H,3-4,6,8-10,12H2,1-2H3
InChIKeyCYAXWSWUTMWOFP-UHFFFAOYSA-N
MW266.45 g/mol
LogP3.66
Rot. Bonds7

About N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine

N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine (PubChem CID 54962549) has the molecular formula C15H26N2S and a molecular weight of 266.45 g/mol. Its IUPAC name is N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine
PubChem CID54962549
Molecular FormulaC15H26N2S
Molecular Weight266.45 g/mol
Exact Mass266.18
IUPAC NameN-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine
SMILESCCCNC1CCN(C(CCC)c2cccs2)C1
InChIInChI=1S/C15H26N2S/c1-3-6-14(15-7-5-11-18-15)17-10-8-13(12-17)16-9-4-2/h5,7,11,13-14,16H,3-4,6,8-10,12H2,1-2H3
InChIKeyCYAXWSWUTMWOFP-UHFFFAOYSA-N
XLogP3.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.45
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(1-thiophen-2-ylbutyl)pyrrolidin-3-yl]methyl]ethanamine
CID 62511490
1-hexan-3-yl-N-propylpyrrolidin-3-amine
CID 62119500
N-ethyl-8-(1-thiophen-2-ylbutyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62738648
N-methyl-8-(1-thiophen-2-ylbutyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62738480
1-[1-(2-chlorophenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 54965482
1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine
CID 103975639
N,3-dimethyl-1-(1-thiophen-2-ylpropyl)piperidin-4-amine
CID 54976100
4-ethenyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-2-one
CID 168683619
1-propan-2-yl-N-(2-thiophen-2-ylpropyl)piperidin-4-amine
CID 75428213
N-propyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine
CID 55126416
2-methyl-1-(1-thiophen-2-ylbutyl)piperazine
CID 64930120
N-propyl-1-(1-pyridin-4-ylethyl)piperidin-4-amine
CID 60860638

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine?
The IUPAC name of N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine (CID 54962549) is N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine.
What is the SMILES notation for N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine?
The canonical SMILES for N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine is CCCNC1CCN(C(CCC)c2cccs2)C1.
What is the InChIKey of N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine?
The InChIKey is CYAXWSWUTMWOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2S/c1-3-6-14(15-7-5-11-18-15)17-10-8-13(12-17)16-9-4-2/h5,7,11,13-14,16H,3-4,6,8-10,12H2,1-2H3.
What are the key properties of N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine?
N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine has a molecular weight of 266.45 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-(1-thiophen-2-ylbutyl)pyrrolidin-3-amine is sourced from PubChem (CID 54962549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).