2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine

C12H26N4O — CID 123317094

IUPAC2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine
SMILESNCCN1CCC(C2COCCN2CCN)C1
InChIInChI=1S/C12H26N4O/c13-2-5-15-4-1-11(9-15)12-10-17-8-7-16(12)6-3-14/h11-12H,1-10,13-14H2
InChIKeyJKEWMDOGNJSZIB-UHFFFAOYSA-N
MW242.37 g/mol
LogP-1.07
Rot. Bonds5

About 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine

2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine (PubChem CID 123317094) has the molecular formula C12H26N4O and a molecular weight of 242.37 g/mol. Its IUPAC name is 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine
PubChem CID123317094
Molecular FormulaC12H26N4O
Molecular Weight242.37 g/mol
Exact Mass242.21
IUPAC Name2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine
SMILESNCCN1CCC(C2COCCN2CCN)C1
InChIInChI=1S/C12H26N4O/c13-2-5-15-4-1-11(9-15)12-10-17-8-7-16(12)6-3-14/h11-12H,1-10,13-14H2
InChIKeyJKEWMDOGNJSZIB-UHFFFAOYSA-N
XLogP-1.07
TPSA67.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-Methoxy-1-(1-methylpyrrolidin-3-yl)ethanamine
CID 20763666
Methyl-[2-pyrrolidin-1-yl-1-(tetrahydro-pyran-4-yl)-ethyl]-amine
CID 44784980
4-{2-[(2S)-2-(Methoxymethyl)pyrrolidin-1-yl]ethyl}piperidine
CID 60012821
1-[[(8S,8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-8-yl]methyl]piperidin-4-amine
CID 67523868
(1S)-1-(oxan-4-yl)-2-pyrrolidin-1-ylethanamine
CID 68030349
1-[2-(Oxolan-3-yl)ethyl]piperazine
CID 68854387
4-[2-[2-(Methoxymethyl)pyrrolidin-1-yl]ethyl]piperidine
CID 69375315
2-Methyl-8-oxa-2-azaspiro[4.5]decan-4-amine
CID 83816210
4-Methyl-3-(1-methylpyrrolidin-3-yl)morpholine
CID 123284893
1-[2-(Oxan-4-yl)ethyl]pyrrolidin-3-amine
CID 130542282
4-[2-[3-(Aminomethyl)pyrrolidin-1-yl]propoxymethyl]-1-propan-2-ylpiperidin-4-amine
CID 139572885
2-[3,4-Bis(2-aminoethyl)morpholin-3-yl]ethanamine
CID 141422887

Frequently Asked Questions

What is the IUPAC name of 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine?
The IUPAC name of 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine (CID 123317094) is 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine.
What is the SMILES notation for 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine?
The canonical SMILES for 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine is NCCN1CCC(C2COCCN2CCN)C1.
What is the InChIKey of 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine?
The InChIKey is JKEWMDOGNJSZIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4O/c13-2-5-15-4-1-11(9-15)12-10-17-8-7-16(12)6-3-14/h11-12H,1-10,13-14H2.
What are the key properties of 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine?
2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine has a molecular weight of 242.37 g/mol, XLogP of -1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[4-(2-aminoethyl)morpholin-3-yl]pyrrolidin-1-yl]ethanamine is sourced from PubChem (CID 123317094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).