2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine

C15H23NO — CID 114157364

IUPAC2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine
SMILESCc1ccc(C(N)C(C)OCCC2CC2)cc1
InChIInChI=1S/C15H23NO/c1-11-3-7-14(8-4-11)15(16)12(2)17-10-9-13-5-6-13/h3-4,7-8,12-13,15H,5-6,9-10,16H2,1-2H3
InChIKeyVJANMFBLEOFSSN-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.20
Rot. Bonds6

About 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine

2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine (PubChem CID 114157364) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine
PubChem CID114157364
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine
SMILESCc1ccc(C(N)C(C)OCCC2CC2)cc1
InChIInChI=1S/C15H23NO/c1-11-3-7-14(8-4-11)15(16)12(2)17-10-9-13-5-6-13/h3-4,7-8,12-13,15H,5-6,9-10,16H2,1-2H3
InChIKeyVJANMFBLEOFSSN-UHFFFAOYSA-N
XLogP3.20
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-2-amine
CID 106199991
2-(3-methylbutoxy)-1-(4-methylphenyl)propan-1-amine
CID 43183851
2-(2-cyclopropylethoxy)-N-methyl-2-(4-methylphenyl)ethanamine
CID 106204976
1-(2-cyclobutylethoxy)-1-(4-methylphenyl)butan-2-amine
CID 106200131
1-(4-methylphenyl)-2-(oxolan-2-ylmethoxy)propan-1-amine
CID 43184114
2-(2-cyclopropylethoxy)-1-(4-ethylphenyl)propan-1-ol
CID 106203961
2-cyclopropyl-1-(4-methylphenyl)ethanamine
CID 22649613
2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine
CID 106201059
1-(4-methoxyphenyl)-2-(2-propan-2-yloxyethoxy)propan-1-amine
CID 43184137
1-(2-cyclopropylethoxy)propan-2-amine
CID 106200486
1-(2-cyclopropylethoxy)-1-(3-methylthiophen-2-yl)propan-2-amine
CID 106199961
2-(2-cyclobutylethoxy)-1-(3,5-dimethylphenyl)ethanamine
CID 106200830

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine?
The IUPAC name of 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine (CID 114157364) is 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine is Cc1ccc(C(N)C(C)OCCC2CC2)cc1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine?
The InChIKey is VJANMFBLEOFSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-3-7-14(8-4-11)15(16)12(2)17-10-9-13-5-6-13/h3-4,7-8,12-13,15H,5-6,9-10,16H2,1-2H3.
What are the key properties of 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine?
2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-1-(4-methylphenyl)propan-1-amine is sourced from PubChem (CID 114157364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).