1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine

C15H25NO3 — CID 43184137

IUPAC1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine
SMILESCOc1ccc(C(N)C(C)OCCOC(C)C)cc1
InChIInChI=1S/C15H25NO3/c1-11(2)18-9-10-19-12(3)15(16)13-5-7-14(17-4)8-6-13/h5-8,11-12,15H,9-10,16H2,1-4H3
InChIKeyFSNUIRXPZCRQMK-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.53
Rot. Bonds8

About 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine

1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine (PubChem CID 43184137) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine
PubChem CID43184137
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine
SMILESCOc1ccc(C(N)C(C)OCCOC(C)C)cc1
InChIInChI=1S/C15H25NO3/c1-11(2)18-9-10-19-12(3)15(16)13-5-7-14(17-4)8-6-13/h5-8,11-12,15H,9-10,16H2,1-4H3
InChIKeyFSNUIRXPZCRQMK-UHFFFAOYSA-N
XLogP2.53
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)ethanamine
CID 43184596
1-(4-methoxyphenyl)-2-N-methyl-2-N-(2-propan-2-yloxyethyl)propane-1,2-diamine
CID 81055276
(1R)-1-(4-methoxyphenyl)-2-methylbutan-1-amine
CID 171200898
1-(4-methoxyphenyl)-3-propan-2-yloxypropan-1-ol
CID 115001584
1-[4-(2-propan-2-yloxyethoxy)phenyl]ethanamine
CID 43189064
1-(4-methoxyphenyl)-2-methylbutane-1,4-diamine
CID 116933980
2-(1-ethoxypropan-2-yloxy)-1-(4-methoxyphenyl)propan-1-amine
CID 103487571
(1S,2R)-1-(4-methoxyphenyl)-2-N-methylpropane-1,2-diamine
CID 163535290
1-(4-methoxyphenyl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 16781513
(1R)-1-[4-[2-(4-methoxyphenoxy)ethoxy]phenyl]ethanamine
CID 79009249
(1S,2R)-1-amino-1-(4-methoxyphenyl)-4-methylpentan-2-ol;hydrochloride
CID 171161991
2-(3-methylbutoxy)-1-(4-methylphenyl)propan-1-amine
CID 43183851

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine?
The IUPAC name of 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine (CID 43184137) is 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine?
The canonical SMILES for 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine is COc1ccc(C(N)C(C)OCCOC(C)C)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine?
The InChIKey is FSNUIRXPZCRQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-11(2)18-9-10-19-12(3)15(16)13-5-7-14(17-4)8-6-13/h5-8,11-12,15H,9-10,16H2,1-4H3.
What are the key properties of 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine?
1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.53, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine is sourced from PubChem (CID 43184137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).