2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine

C14H22N2O — CID 82083200

IUPAC2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
SMILESCc1ccc(C(CN)CN2CCOCC2)cc1
InChIInChI=1S/C14H22N2O/c1-12-2-4-13(5-3-12)14(10-15)11-16-6-8-17-9-7-16/h2-5,14H,6-11,15H2,1H3
InChIKeyMGRRUKATOJYFHA-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.37
Rot. Bonds4

About 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine

2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine (PubChem CID 82083200) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
PubChem CID82083200
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
SMILESCc1ccc(C(CN)CN2CCOCC2)cc1
InChIInChI=1S/C14H22N2O/c1-12-2-4-13(5-3-12)14(10-15)11-16-6-8-17-9-7-16/h2-5,14H,6-11,15H2,1H3
InChIKeyMGRRUKATOJYFHA-UHFFFAOYSA-N
XLogP1.37
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 ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-morpholin-4-yl-2-(2,4,6-trimethylphenyl)propan-1-amine
CID 82090983
1-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine
CID 62618530
1-(4-methylphenyl)-N-(1-morpholin-4-ylpropan-2-yl)propan-1-amine
CID 43675888
3-(4-methylphenyl)-2-morpholin-4-ylbutan-1-amine
CID 82086961
(2S)-3-(4-methylpiperazin-1-yl)-2-phenylpropan-1-amine
CID 93102230
4-[2-(4-methylphenyl)sulfanylethyl]morpholine
CID 21317501
3,4-dimethyl-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 9144477
1-[4-amino-3-(4-methylphenyl)butyl]piperidin-4-amine
CID 142172122
4-[(2R)-2-(4-phenylphenyl)propyl]morpholine
CID 96566967
3-(4-methylpiperazin-1-yl)-2-pyridin-4-ylpropan-1-amine
CID 82107783
(2R)-1-(4-methylphenyl)sulfanyl-4-morpholin-4-ylbutan-2-amine
CID 67069266
ethane;1-(4-methylphenoxy)-3-morpholin-4-ylpropan-2-ol
CID 144771734

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
The IUPAC name of 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine (CID 82083200) is 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine is Cc1ccc(C(CN)CN2CCOCC2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
The InChIKey is MGRRUKATOJYFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12-2-4-13(5-3-12)14(10-15)11-16-6-8-17-9-7-16/h2-5,14H,6-11,15H2,1H3.
What are the key properties of 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine?
2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine has a molecular weight of 234.34 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-3-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 82083200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).