N-(3-phenoxypropyl)morpholin-4-amine

C13H20N2O2 — CID 83021073

IUPACN-(3-phenoxypropyl)morpholin-4-amine
SMILESc1ccc(OCCCNN2CCOCC2)cc1
InChIInChI=1S/C13H20N2O2/c1-2-5-13(6-3-1)17-10-4-7-14-15-8-11-16-12-9-15/h1-3,5-6,14H,4,7-12H2
InChIKeyHPVPABGJVROHRG-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.29
Rot. Bonds6

About N-(3-phenoxypropyl)morpholin-4-amine

N-(3-phenoxypropyl)morpholin-4-amine (PubChem CID 83021073) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(3-phenoxypropyl)morpholin-4-amine.

Molecular Properties

Compound NameN-(3-phenoxypropyl)morpholin-4-amine
PubChem CID83021073
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(3-phenoxypropyl)morpholin-4-amine
SMILESc1ccc(OCCCNN2CCOCC2)cc1
InChIInChI=1S/C13H20N2O2/c1-2-5-13(6-3-1)17-10-4-7-14-15-8-11-16-12-9-15/h1-3,5-6,14H,4,7-12H2
InChIKeyHPVPABGJVROHRG-UHFFFAOYSA-N
XLogP1.29
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-phenoxypropyl)morpholin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(3-bromophenoxy)ethyl]morpholin-4-amine
CID 83021921
1-(morpholin-4-ylamino)-3-phenoxypropan-2-ol
CID 83021932
N-[(4-butoxyphenyl)methyl]morpholin-4-amine
CID 83012107
(2R)-2-methyl-N-morpholin-4-yl-4-phenoxybutanamide
CID 95901650
2-methyl-N-morpholin-4-yl-4-phenoxybutanamide
CID 71985237
1-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-3-(3-phenoxypropyl)urea
CID 36524900
3-phenoxy-N-(3-phenoxypropyl)propan-1-amine;hydrochloride
CID 18793133
1-ethyl-2-(3-morpholin-4-ylpropyl)-3-(2-phenoxyethyl)guanidine
CID 110972471
N-(3-phenoxypropyl)oxolan-3-amine
CID 63335382
N-methyl-3-phenoxypropan-1-amine
CID 22067856
N-(4-morpholin-4-ylphenyl)-3-phenoxypropanamide
CID 26269482
N-(2-phenoxyethyl)-1,2-oxazolidine-2-carboxamide
CID 100767762

Frequently Asked Questions

What is the IUPAC name of N-(3-phenoxypropyl)morpholin-4-amine?
The IUPAC name of N-(3-phenoxypropyl)morpholin-4-amine (CID 83021073) is N-(3-phenoxypropyl)morpholin-4-amine.
What is the SMILES notation for N-(3-phenoxypropyl)morpholin-4-amine?
The canonical SMILES for N-(3-phenoxypropyl)morpholin-4-amine is c1ccc(OCCCNN2CCOCC2)cc1.
What is the InChIKey of N-(3-phenoxypropyl)morpholin-4-amine?
The InChIKey is HPVPABGJVROHRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-5-13(6-3-1)17-10-4-7-14-15-8-11-16-12-9-15/h1-3,5-6,14H,4,7-12H2.
What are the key properties of N-(3-phenoxypropyl)morpholin-4-amine?
N-(3-phenoxypropyl)morpholin-4-amine has a molecular weight of 236.31 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenoxypropyl)morpholin-4-amine is sourced from PubChem (CID 83021073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).