2-(2-cyclobutylphenyl)cyclobutan-1-amine

C14H19N — CID 114607226

IUPAC2-(2-cyclobutylphenyl)cyclobutan-1-amine
SMILESNC1CCC1c1ccccc1C1CCC1
InChIInChI=1S/C14H19N/c15-14-9-8-13(14)12-7-2-1-6-11(12)10-4-3-5-10/h1-2,6-7,10,13-14H,3-5,8-9,15H2
InChIKeySHLAKAMKMMMLQV-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.16
Rot. Bonds2

About 2-(2-cyclobutylphenyl)cyclobutan-1-amine

2-(2-cyclobutylphenyl)cyclobutan-1-amine (PubChem CID 114607226) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-(2-cyclobutylphenyl)cyclobutan-1-amine.

Molecular Properties

Compound Name2-(2-cyclobutylphenyl)cyclobutan-1-amine
PubChem CID114607226
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name2-(2-cyclobutylphenyl)cyclobutan-1-amine
SMILESNC1CCC1c1ccccc1C1CCC1
InChIInChI=1S/C14H19N/c15-14-9-8-13(14)12-7-2-1-6-11(12)10-4-3-5-10/h1-2,6-7,10,13-14H,3-5,8-9,15H2
InChIKeySHLAKAMKMMMLQV-UHFFFAOYSA-N
XLogP3.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromophenyl)cyclobutan-1-amine
CID 105483632
cis-(1R,2R)-2-(2-chlorophenyl)cyclopentan-1-amine
CID 94869146
2-(2-fluorophenyl)cyclopentan-1-amine
CID 62605662
tricyclo[6.2.2.02,7]dodeca-2,4,6-triene
CID 582301
(5S)-tricyclo[4.4.0.02,5]deca-1(10),6,8-triene
CID 68882978
2,6-di(cyclobutyl)aniline
CID 172550384
[2-[(1R,2R)-2-aminocyclopentyl]phenyl]methanol
CID 131172314
trans-(1S,2R)-2-[2-(trifluoromethyl)phenyl]cyclopentan-1-amine
CID 94603915
(1R,9S)-tricyclo[7.3.1.02,7]trideca-2,4,6-trien-8-amine
CID 130765038
(2-cyclobutylphenyl)-cyclopropylmethanamine
CID 114602603
2-(2-cyclobutylphenyl)cyclohexan-1-one
CID 114605762
trans-(1R,2S)-2-[2-(trifluoromethyl)phenyl]cyclohexan-1-amine
CID 94603912

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclobutylphenyl)cyclobutan-1-amine?
The IUPAC name of 2-(2-cyclobutylphenyl)cyclobutan-1-amine (CID 114607226) is 2-(2-cyclobutylphenyl)cyclobutan-1-amine.
What is the SMILES notation for 2-(2-cyclobutylphenyl)cyclobutan-1-amine?
The canonical SMILES for 2-(2-cyclobutylphenyl)cyclobutan-1-amine is NC1CCC1c1ccccc1C1CCC1.
What is the InChIKey of 2-(2-cyclobutylphenyl)cyclobutan-1-amine?
The InChIKey is SHLAKAMKMMMLQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c15-14-9-8-13(14)12-7-2-1-6-11(12)10-4-3-5-10/h1-2,6-7,10,13-14H,3-5,8-9,15H2.
What are the key properties of 2-(2-cyclobutylphenyl)cyclobutan-1-amine?
2-(2-cyclobutylphenyl)cyclobutan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylphenyl)cyclobutan-1-amine is sourced from PubChem (CID 114607226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).