1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine

C15H23N — CID 114602608

IUPAC1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)C(N)c1cccc(C2CCC2)c1
InChIInChI=1S/C15H23N/c1-15(2,3)14(16)13-9-5-8-12(10-13)11-6-4-7-11/h5,8-11,14H,4,6-7,16H2,1-3H3
InChIKeyYZYXHTPKRJUTDY-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.00
Rot. Bonds2

About 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine

1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine (PubChem CID 114602608) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine
PubChem CID114602608
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)C(N)c1cccc(C2CCC2)c1
InChIInChI=1S/C15H23N/c1-15(2,3)14(16)13-9-5-8-12(10-13)11-6-4-7-11/h5,8-11,14H,4,6-7,16H2,1-3H3
InChIKeyYZYXHTPKRJUTDY-UHFFFAOYSA-N
XLogP4.00
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-cyclobutylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 114603703
1-(3-cyclobutylphenyl)-2-methylbutan-1-amine
CID 114603023
1-(3-cyclobutylphenyl)-2-propan-2-ylsulfanylethanamine
CID 114603248
1-(3-cyclobutylphenyl)-2-cyclopropylethane-1,2-diol
CID 103456751
1-(3-cyclobutylphenyl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol
CID 103312671
(3-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
CID 114602513
[1-(3-cyclobutylphenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]hydrazine
CID 105342062
(1R)-1-(3-cyclobutylphenyl)-2,2,2-trifluoroethanol
CID 104939857
(4-bromo-3-methylphenyl)-(3-cyclobutylphenyl)methanamine
CID 105053825
1-(3-cyclobutylphenyl)-2-ethoxypropan-1-amine
CID 114603153
(3-cyclobutylphenyl)-(1-methylpyrazol-4-yl)methanamine
CID 114603326
(4-chloro-3-methylphenyl)-(3-cyclobutylphenyl)methanamine
CID 105053710

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine?
The IUPAC name of 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine (CID 114602608) is 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine?
The canonical SMILES for 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine is CC(C)(C)C(N)c1cccc(C2CCC2)c1.
What is the InChIKey of 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine?
The InChIKey is YZYXHTPKRJUTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-15(2,3)14(16)13-9-5-8-12(10-13)11-6-4-7-11/h5,8-11,14H,4,6-7,16H2,1-3H3.
What are the key properties of 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine?
1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclobutylphenyl)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 114602608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).