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

C15H21NO — CID 105051847

IUPAC2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine
SMILESCC(C1CC1)C(N)c1cccc(OC2CC2)c1
InChIInChI=1S/C15H21NO/c1-10(11-5-6-11)15(16)12-3-2-4-14(9-12)17-13-7-8-13/h2-4,9-11,13,15H,5-8,16H2,1H3
InChIKeyAJNXTOBQNGKOGQ-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.27
Rot. Bonds5

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

2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine (PubChem CID 105051847) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine
PubChem CID105051847
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine
SMILESCC(C1CC1)C(N)c1cccc(OC2CC2)c1
InChIInChI=1S/C15H21NO/c1-10(11-5-6-11)15(16)12-3-2-4-14(9-12)17-13-7-8-13/h2-4,9-11,13,15H,5-8,16H2,1H3
InChIKeyAJNXTOBQNGKOGQ-UHFFFAOYSA-N
XLogP3.27
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine
CID 115785759
2-cyclopropyl-1-[3-(trifluoromethoxy)phenyl]propan-1-amine
CID 115854106
1-cyclopentyloxy-3-propan-2-ylbenzene
CID 140909564
1-(3-cyclopropyloxyphenyl)-2-phenylbutan-1-amine
CID 105051796
1-(3-cyclopropyloxyphenyl)-2-methoxypentan-1-amine
CID 114522245
1-(3-cyclopropyloxyphenyl)-2-methylsulfanylethanamine
CID 114521659
(2S)-2-amino-2-(3-cyclopropyloxyphenyl)ethanol
CID 129319999
1-[3-(3,4-dimethylcyclohexyl)oxyphenyl]ethanamine
CID 64740732
(1R)-1-(3-cyclopentyloxyphenyl)ethane-1,2-diamine
CID 66517730
[1-(3-cyclopropyloxyphenyl)-3-methylbutyl]hydrazine
CID 105199146
1-(3-cyclopropyloxyphenyl)-2,2-dimethylbutan-1-amine
CID 105051843
(3-cyclopropyloxyphenyl)-(2,2-dimethylcyclohexyl)methanamine
CID 107191370

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine (CID 105051847) is 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine is CC(C1CC1)C(N)c1cccc(OC2CC2)c1.
What is the InChIKey of 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine?
The InChIKey is AJNXTOBQNGKOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-10(11-5-6-11)15(16)12-3-2-4-14(9-12)17-13-7-8-13/h2-4,9-11,13,15H,5-8,16H2,1H3.
What are the key properties of 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine?
2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine has a molecular weight of 231.34 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine is sourced from PubChem (CID 105051847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).