2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine

C8H19N3 — CID 83963140

IUPAC2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine
SMILESNCCC1CCN(CCN)C1
InChIInChI=1S/C8H19N3/c9-3-1-8-2-5-11(7-8)6-4-10/h8H,1-7,9-10H2
InChIKeyRFJQQPFQANKPHR-UHFFFAOYSA-N
MW157.26 g/mol
LogP-0.38
Rot. Bonds4

About 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine

2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine (PubChem CID 83963140) has the molecular formula C8H19N3 and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine
PubChem CID83963140
Molecular FormulaC8H19N3
Molecular Weight157.26 g/mol
Exact Mass157.16
IUPAC Name2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine
SMILESNCCC1CCN(CCN)C1
InChIInChI=1S/C8H19N3/c9-3-1-8-2-5-11(7-8)6-4-10/h8H,1-7,9-10H2
InChIKeyRFJQQPFQANKPHR-UHFFFAOYSA-N
XLogP-0.38
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R)-1-propylpyrrolidin-3-yl]ethanamine
CID 86324396
2-[1-(2-aminoethyl)pyrrolidin-3-yl]-N-ethylethanamine
CID 83963170
2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]ethanamine
CID 114802641
2-[1-(4-methoxybutyl)pyrrolidin-3-yl]ethanamine
CID 114802487
2-[3-(methylsulfanylmethyl)pyrrolidin-1-yl]ethanamine
CID 131206914
2-[1-(2-fluoroethyl)piperidin-3-yl]ethanamine
CID 80695268
2-[1-(3-ethylsulfonylpropyl)pyrrolidin-3-yl]ethanamine
CID 114802608
2-[1-[2-(1-methylpiperidin-2-yl)ethyl]pyrrolidin-3-yl]ethanamine
CID 114015284
2-[1-(2-butoxyethyl)pyrrolidin-3-yl]ethanamine
CID 114802527
N-[2-[3-(2-aminoethyl)pyrrolidin-1-yl]ethyl]-N-ethylpropan-1-amine
CID 83963240
2-[(3S)-3-(ethoxymethyl)pyrrolidin-1-yl]ethanamine
CID 129322519
2-[3-(diethylaminomethyl)pyrrolidin-1-yl]ethanamine
CID 19846080

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine?
The IUPAC name of 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine (CID 83963140) is 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine?
The canonical SMILES for 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine is NCCC1CCN(CCN)C1.
What is the InChIKey of 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine?
The InChIKey is RFJQQPFQANKPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3/c9-3-1-8-2-5-11(7-8)6-4-10/h8H,1-7,9-10H2.
What are the key properties of 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine?
2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine has a molecular weight of 157.26 g/mol, XLogP of -0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine is sourced from PubChem (CID 83963140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).