1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol

C15H24N2O3 — CID 114398972

IUPAC1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
SMILESNCC1CN(CC(O)COCc2ccccc2)CCO1
InChIInChI=1S/C15H24N2O3/c16-8-15-10-17(6-7-20-15)9-14(18)12-19-11-13-4-2-1-3-5-13/h1-5,14-15,18H,6-12,16H2
InChIKeyGJGWHHWLMHLTDZ-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.22
Rot. Bonds7

About 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol

1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol (PubChem CID 114398972) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol.

Molecular Properties

Compound Name1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
PubChem CID114398972
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
SMILESNCC1CN(CC(O)COCc2ccccc2)CCO1
InChIInChI=1S/C15H24N2O3/c16-8-15-10-17(6-7-20-15)9-14(18)12-19-11-13-4-2-1-3-5-13/h1-5,14-15,18H,6-12,16H2
InChIKeyGJGWHHWLMHLTDZ-UHFFFAOYSA-N
XLogP0.22
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-1-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-3-phenylmethoxypropan-2-ol
CID 95330936
1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
CID 110929071
(2S)-1-[(4-chlorophenyl)methoxy]-3-[(2S)-2-[(dimethylamino)methyl]morpholin-4-yl]propan-2-ol
CID 95332227
N-cyclopentyl-N-[[4-(2-hydroxy-3-phenylmethoxypropyl)morpholin-2-yl]methyl]-4-methylbenzamide
CID 42862417
(2S)-1-phenylmethoxy-3-pyrrolidin-1-ylpropan-2-ol
CID 740501
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-3-phenylmethoxypropan-2-ol
CID 112734049
1-phenylmethoxy-3-piperidin-1-ylpropan-2-ol
CID 2769742
1-phenylmethoxy-3-pyrrolidin-1-ylpropan-2-ol chloride
CID 53346846
1-(2-hydroxy-3-phenylmethoxypropyl)piperidin-4-ol
CID 60632394
1-[(2R)-2-hydroxy-3-phenylmethoxypropyl]piperidin-4-ol
CID 95232047
1-phenylmethoxy-3-piperidin-1-ylpropan-2-ol chloride
CID 21236635
1-(2,2-dimethylmorpholin-4-yl)-3-phenylmethoxypropan-2-ol
CID 60761061

Frequently Asked Questions

What is the IUPAC name of 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
The IUPAC name of 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol (CID 114398972) is 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol.
What is the SMILES notation for 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
The canonical SMILES for 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol is NCC1CN(CC(O)COCc2ccccc2)CCO1.
What is the InChIKey of 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
The InChIKey is GJGWHHWLMHLTDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c16-8-15-10-17(6-7-20-15)9-14(18)12-19-11-13-4-2-1-3-5-13/h1-5,14-15,18H,6-12,16H2.
What are the key properties of 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol?
1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol has a molecular weight of 280.37 g/mol, XLogP of 0.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(aminomethyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol is sourced from PubChem (CID 114398972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).