(2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine

C13H20N2O2 — CID 28920169

IUPAC(2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine
SMILESNC[C@@H](COc1ccccc1)N1CCOCC1
InChIInChI=1S/C13H20N2O2/c14-10-12(15-6-8-16-9-7-15)11-17-13-4-2-1-3-5-13/h1-5,12H,6-11,14H2/t12-/m0/s1
InChIKeyICYGHCFXYNUIJU-LBPRGKRZSA-N
MW236.31 g/mol
LogP0.72
Rot. Bonds5

About (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine

(2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine (PubChem CID 28920169) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine.

Molecular Properties

Compound Name(2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine
PubChem CID28920169
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name(2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine
SMILESNC[C@@H](COc1ccccc1)N1CCOCC1
InChIInChI=1S/C13H20N2O2/c14-10-12(15-6-8-16-9-7-15)11-17-13-4-2-1-3-5-13/h1-5,12H,6-11,14H2/t12-/m0/s1
InChIKeyICYGHCFXYNUIJU-LBPRGKRZSA-N
XLogP0.72
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-methoxyphenoxy)-2-morpholin-4-ylpropan-1-amine
CID 112500977
4-(4-fluorophenoxy)-3-morpholin-4-ylbutan-1-amine
CID 112501047
3-(4-methylpiperazin-1-yl)-4-phenoxybutan-1-amine
CID 112501048
2-morpholin-4-yl-2-(4-phenylmethoxyphenyl)ethanamine
CID 16642933
2-morpholin-4-yl-3-propan-2-yloxypropan-1-amine
CID 119093890
3-(4-propan-2-ylphenoxy)-2-pyrrolidin-1-ylpropan-1-amine
CID 112500967
3-methoxy-2-(1,4-oxazepan-4-yl)propan-1-amine
CID 103226384
1-(morpholin-4-ylamino)-3-phenoxypropan-2-ol
CID 83021932
1-[1,3-bis(4-methylphenoxy)propan-2-yl]-4-phenylpiperazine
CID 110181956
N-[(2R,3S)-3-morpholin-4-ylbutan-2-yl]-3-phenoxypropanamide
CID 95340867
4-pentan-3-ylmorpholine
CID 641553
(2R)-2-morpholin-4-yl-3-phenylpropan-1-ol
CID 107861547

Frequently Asked Questions

What is the IUPAC name of (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine?
The IUPAC name of (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine (CID 28920169) is (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine.
What is the SMILES notation for (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine?
The canonical SMILES for (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine is NC[C@@H](COc1ccccc1)N1CCOCC1.
What is the InChIKey of (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine?
The InChIKey is ICYGHCFXYNUIJU-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H20N2O2/c14-10-12(15-6-8-16-9-7-15)11-17-13-4-2-1-3-5-13/h1-5,12H,6-11,14H2/t12-/m0/s1.
What are the key properties of (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine?
(2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine has a molecular weight of 236.31 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-morpholin-4-yl-3-phenoxypropan-1-amine is sourced from PubChem (CID 28920169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).