1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine

C14H22N2O — CID 62618530

IUPAC1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
SMILESCc1ccc(C(N)CCN2CCOCC2)cc1
InChIInChI=1S/C14H22N2O/c1-12-2-4-13(5-3-12)14(15)6-7-16-8-10-17-11-9-16/h2-5,14H,6-11,15H2,1H3
InChIKeyJCRZUWPXLQNFJI-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.72
Rot. Bonds4

About 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine

1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine (PubChem CID 62618530) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
PubChem CID62618530
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
SMILESCc1ccc(C(N)CCN2CCOCC2)cc1
InChIInChI=1S/C14H22N2O/c1-12-2-4-13(5-3-12)14(15)6-7-16-8-10-17-11-9-16/h2-5,14H,6-11,15H2,1H3
InChIKeyJCRZUWPXLQNFJI-UHFFFAOYSA-N
XLogP1.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methylphenyl)-3-[4-(2-methylpropyl)piperazin-1-yl]propan-1-amine
CID 62778017
(2R)-1-(4-methylphenyl)sulfanyl-4-morpholin-4-ylbutan-2-amine
CID 67069266
3-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(4-methylphenyl)propan-1-amine
CID 62618231
3-(4-methyl-1,4-diazepan-1-yl)-1-(4-methylphenyl)propan-1-amine
CID 62618540
2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
CID 82083200
3-(3-ethylpiperidin-1-yl)-1-(4-methylphenyl)propan-1-amine
CID 62617209
4-[2-(4-methylphenyl)sulfanylethyl]morpholine
CID 21317501
2-amino-2-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)acetamide;dihydrochloride
CID 120669272
1-(2-bromophenyl)-3-morpholin-4-ylpropan-1-amine
CID 55098547
1-(4-chlorophenyl)-3-(4-ethylpiperazin-1-yl)propan-1-amine
CID 62644602
3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol
CID 82105505
[4-[3-amino-3-(4-methylphenyl)propyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114780269

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
The IUPAC name of 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine (CID 62618530) is 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine is Cc1ccc(C(N)CCN2CCOCC2)cc1.
What is the InChIKey of 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
The InChIKey is JCRZUWPXLQNFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12-2-4-13(5-3-12)14(15)6-7-16-8-10-17-11-9-16/h2-5,14H,6-11,15H2,1H3.
What are the key properties of 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine has a molecular weight of 234.34 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 62618530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).