2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine

C14H21NO — CID 83155175

IUPAC2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine
SMILESCOc1ccc(C)cc1C(N)C(C)C1CC1
InChIInChI=1S/C14H21NO/c1-9-4-7-13(16-3)12(8-9)14(15)10(2)11-5-6-11/h4,7-8,10-11,14H,5-6,15H2,1-3H3
InChIKeyCRXYSEYSBKQOAE-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.05
Rot. Bonds4

About 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine

2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine (PubChem CID 83155175) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine
PubChem CID83155175
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine
SMILESCOc1ccc(C)cc1C(N)C(C)C1CC1
InChIInChI=1S/C14H21NO/c1-9-4-7-13(16-3)12(8-9)14(15)10(2)11-5-6-11/h4,7-8,10-11,14H,5-6,15H2,1-3H3
InChIKeyCRXYSEYSBKQOAE-UHFFFAOYSA-N
XLogP3.05
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(5-fluoro-2-methoxyphenyl)propan-1-amine
CID 83154876
2-cyclopropyl-1-(2-methoxy-5-methylphenyl)-N-methylpropan-1-amine
CID 83155274
2-cyclopropyl-1-(2,5-dimethylphenyl)propan-1-amine
CID 83154374
1-(2-methoxy-5-methylphenyl)-2-methylpropane-1,3-diamine
CID 116933048
2-cyclopropyl-1-(3,4-dimethoxyphenyl)propan-1-amine
CID 83155157
N-(dicyclopropylmethyl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43204161
(4,4-dimethylcyclohexyl)-(2-methoxy-5-methylphenyl)methanamine
CID 65391223
3-amino-1-cyclopropyl-2-(2-methoxy-5-methylphenyl)propan-1-ol
CID 65185180
2-cyclopropyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990610
1-cyclohexyl-2-(2-methoxy-5-methylphenyl)ethane-1,2-diol
CID 103459031
1-(2-methoxy-5-methylphenyl)-2-piperazin-1-ylpropan-1-amine
CID 116946739
2-(cyclopentylamino)-1-(2-methoxy-5-methylphenyl)propan-1-ol
CID 82313684

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine (CID 83155175) is 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine is COc1ccc(C)cc1C(N)C(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine?
The InChIKey is CRXYSEYSBKQOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9-4-7-13(16-3)12(8-9)14(15)10(2)11-5-6-11/h4,7-8,10-11,14H,5-6,15H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine?
2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine is sourced from PubChem (CID 83155175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).