2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine

C13H19NO — CID 115785759

IUPAC2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine
SMILESCOc1cccc(C(N)C(C)C2CC2)c1
InChIInChI=1S/C13H19NO/c1-9(10-6-7-10)13(14)11-4-3-5-12(8-11)15-2/h3-5,8-10,13H,6-7,14H2,1-2H3
InChIKeyOXRYKZIMHQQIRI-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.74
Rot. Bonds4

About 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine

2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine (PubChem CID 115785759) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine
PubChem CID115785759
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine
SMILESCOc1cccc(C(N)C(C)C2CC2)c1
InChIInChI=1S/C13H19NO/c1-9(10-6-7-10)13(14)11-4-3-5-12(8-11)15-2/h3-5,8-10,13H,6-7,14H2,1-2H3
InChIKeyOXRYKZIMHQQIRI-UHFFFAOYSA-N
XLogP2.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine
CID 105051847
2-cyclopropyl-1-[3-(trifluoromethoxy)phenyl]propan-1-amine
CID 115854106
[2-cyclopropyl-1-(3-methoxyphenyl)propyl]hydrazine
CID 105283576
1-(3-methoxyphenyl)-2,3-dimethylbutan-1-amine
CID 115785901
2-cyclopropyl-1-(3-methoxyphenyl)ethanamine
CID 55295548
[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232508
1-(3-methoxyphenyl)ethanamine;hydrochloride
CID 19864848
methane;(1R)-1-(3-methoxyphenyl)ethanamine
CID 160746722
2-cyclopropyl-1-(2,4,6-trimethoxyphenyl)propan-1-amine
CID 83154373
2-cyclopropyl-2-(3-methoxyphenyl)acetic acid
CID 82024075
2-(3-methoxyphenyl)-1-phenylpropan-1-amine
CID 57276567
1,3-dicyclopropyl-1,3-bis(3-methoxyphenyl)propan-2-one
CID 141244570

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine (CID 115785759) is 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine is COc1cccc(C(N)C(C)C2CC2)c1.
What is the InChIKey of 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine?
The InChIKey is OXRYKZIMHQQIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9(10-6-7-10)13(14)11-4-3-5-12(8-11)15-2/h3-5,8-10,13H,6-7,14H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine?
2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine is sourced from PubChem (CID 115785759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).