3-amino-2-(morpholin-4-ylmethyl)phenol;azane

C11H19N3O2 — CID 69382401

IUPAC3-amino-2-(morpholin-4-ylmethyl)phenol;azane
SMILESN.Nc1cccc(O)c1CN1CCOCC1
InChIInChI=1S/C11H16N2O2.H3N/c12-10-2-1-3-11(14)9(10)8-13-4-6-15-7-5-13;/h1-3,14H,4-8,12H2;1H3
InChIKeyDLRVNJCEICUTFS-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.97
Rot. Bonds2

About 3-amino-2-(morpholin-4-ylmethyl)phenol;azane

3-amino-2-(morpholin-4-ylmethyl)phenol;azane (PubChem CID 69382401) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-amino-2-(morpholin-4-ylmethyl)phenol;azane.

Molecular Properties

Compound Name3-amino-2-(morpholin-4-ylmethyl)phenol;azane
PubChem CID69382401
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-amino-2-(morpholin-4-ylmethyl)phenol;azane
SMILESN.Nc1cccc(O)c1CN1CCOCC1
InChIInChI=1S/C11H16N2O2.H3N/c12-10-2-1-3-11(14)9(10)8-13-4-6-15-7-5-13;/h1-3,14H,4-8,12H2;1H3
InChIKeyDLRVNJCEICUTFS-UHFFFAOYSA-N
XLogP0.97
TPSA93.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-chloro-2-(1,4-oxazepan-4-ylmethyl)aniline
CID 63745239
2-(2-morpholin-4-ylethyl)benzene-1,3-diamine
CID 140755433
3,4-dichloro-2-(morpholin-4-ylmethyl)phenol
CID 12823160
3-amino-2,4,6-tris(morpholin-4-ylmethyl)phenol
CID 139658917
3-[[16-[(3-aminophenyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]aniline
CID 15495103
2-(morpholin-4-ylmethyl)furan-3-amine
CID 82407819
5-amino-2-(morpholin-4-ylmethyl)phenol
CID 19799808
2,4-difluoro-3-(morpholin-4-ylmethyl)phenol
CID 126778749
3-(morpholin-4-ylmethyl)-2-phenylphenol
CID 174703576
3-(morpholin-4-ylmethyl)-1-benzofuran-7-ol
CID 84696625
10-(anthracen-9-ylmethyl)-1,4,7-trioxa-10-azacyclododecane
CID 101025185
3-hydroxy-4-(morpholin-4-ylmethyl)benzo[c]chromen-6-one
CID 5392010

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(morpholin-4-ylmethyl)phenol;azane?
The IUPAC name of 3-amino-2-(morpholin-4-ylmethyl)phenol;azane (CID 69382401) is 3-amino-2-(morpholin-4-ylmethyl)phenol;azane.
What is the SMILES notation for 3-amino-2-(morpholin-4-ylmethyl)phenol;azane?
The canonical SMILES for 3-amino-2-(morpholin-4-ylmethyl)phenol;azane is N.Nc1cccc(O)c1CN1CCOCC1.
What is the InChIKey of 3-amino-2-(morpholin-4-ylmethyl)phenol;azane?
The InChIKey is DLRVNJCEICUTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2.H3N/c12-10-2-1-3-11(14)9(10)8-13-4-6-15-7-5-13;/h1-3,14H,4-8,12H2;1H3.
What are the key properties of 3-amino-2-(morpholin-4-ylmethyl)phenol;azane?
3-amino-2-(morpholin-4-ylmethyl)phenol;azane has a molecular weight of 225.29 g/mol, XLogP of 0.97, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(morpholin-4-ylmethyl)phenol;azane is sourced from PubChem (CID 69382401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).