2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine

C15H23NO — CID 83154112

IUPAC2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine
SMILESCOc1c(C)cc(C(N)C(C)C2CC2)cc1C
InChIInChI=1S/C15H23NO/c1-9-7-13(8-10(2)15(9)17-4)14(16)11(3)12-5-6-12/h7-8,11-12,14H,5-6,16H2,1-4H3
InChIKeyYSGLWUDOFCQVOK-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.36
Rot. Bonds4

About 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine

2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine (PubChem CID 83154112) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine
PubChem CID83154112
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine
SMILESCOc1c(C)cc(C(N)C(C)C2CC2)cc1C
InChIInChI=1S/C15H23NO/c1-9-7-13(8-10(2)15(9)17-4)14(16)11(3)12-5-6-12/h7-8,11-12,14H,5-6,16H2,1-4H3
InChIKeyYSGLWUDOFCQVOK-UHFFFAOYSA-N
XLogP3.36
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-cyclopropyl-(4-methoxy-3,5-dimethylphenyl)methanamine;hydrochloride
CID 171211641
5-[bromo(cyclopropyl)methyl]-2-methoxy-1,3-dimethylbenzene
CID 83068810
1-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)-N-methylmethanamine
CID 83057729
2-cyclopropyl-1-(3,4-dimethoxyphenyl)propan-1-amine
CID 83155157
2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine
CID 115785759
6-bicyclo[3.1.0]hexanyl-(4-methoxy-3,5-dimethylphenyl)methanamine
CID 83057726
3-[amino-(4-methoxy-3,5-dimethylphenyl)methyl]cyclobutan-1-amine
CID 116937420
1-(3-chloro-4-methylphenyl)-2-cyclopropylpropan-1-amine
CID 107561849
2-amino-1-(4-methoxy-3,5-dimethylphenyl)propan-1-ol
CID 82395059
2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine
CID 83154874
2-cyclopropyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990610
2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine
CID 83155175

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine (CID 83154112) is 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine is COc1c(C)cc(C(N)C(C)C2CC2)cc1C.
What is the InChIKey of 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine?
The InChIKey is YSGLWUDOFCQVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-9-7-13(8-10(2)15(9)17-4)14(16)11(3)12-5-6-12/h7-8,11-12,14H,5-6,16H2,1-4H3.
What are the key properties of 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine?
2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine has a molecular weight of 233.35 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(4-methoxy-3,5-dimethylphenyl)propan-1-amine is sourced from PubChem (CID 83154112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).