3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine

C17H27N3O — CID 63171689

IUPAC3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine
SMILESNCCC(c1ccccc1)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C17H27N3O/c18-8-6-17(15-4-2-1-3-5-15)20-9-7-16(14-20)19-10-12-21-13-11-19/h1-5,16-17H,6-14,18H2
InChIKeyRYLKVAOTSFYCHT-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.48
Rot. Bonds5

About 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine

3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine (PubChem CID 63171689) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine.

Molecular Properties

Compound Name3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine
PubChem CID63171689
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine
SMILESNCCC(c1ccccc1)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C17H27N3O/c18-8-6-17(15-4-2-1-3-5-15)20-9-7-16(14-20)19-10-12-21-13-11-19/h1-5,16-17H,6-14,18H2
InChIKeyRYLKVAOTSFYCHT-UHFFFAOYSA-N
XLogP1.48
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine
CID 63172030
2-(3-chlorophenyl)-2-(3-morpholin-4-ylpyrrolidin-1-yl)ethanamine
CID 63171639
3-phenyl-3-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103494242
3-(4-ethylpiperidin-1-yl)-3-phenylpropan-1-amine
CID 62780033
3-phenyl-3-(3-propylpyrrolidin-1-yl)propan-1-amine
CID 113417035
2-(3-bromothiophen-2-yl)-2-(3-morpholin-4-ylpyrrolidin-1-yl)ethanamine
CID 115380442
2-(4-chlorophenyl)-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
CID 63171544
2-(4-hydroxypiperidin-1-yl)-1-(3-morpholin-4-ylpyrrolidin-1-yl)-2-phenylethanone
CID 127361433
3,3-dimethyl-2-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-amine
CID 63171723
methyl 1-(3-amino-1-phenylpropyl)piperidine-4-carboxylate
CID 63382677
1-(2-amino-1-phenylethyl)pyrrolidin-3-ol
CID 62941324
3-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-3-phenylpropan-1-amine
CID 79919963

Frequently Asked Questions

What is the IUPAC name of 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine?
The IUPAC name of 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine (CID 63171689) is 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine.
What is the SMILES notation for 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine?
The canonical SMILES for 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine is NCCC(c1ccccc1)N1CCC(N2CCOCC2)C1.
What is the InChIKey of 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine?
The InChIKey is RYLKVAOTSFYCHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c18-8-6-17(15-4-2-1-3-5-15)20-9-7-16(14-20)19-10-12-21-13-11-19/h1-5,16-17H,6-14,18H2.
What are the key properties of 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine?
3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine has a molecular weight of 289.42 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-morpholin-4-ylpyrrolidin-1-yl)-3-phenylpropan-1-amine is sourced from PubChem (CID 63171689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).