3-(2-cyclobutylphenyl)-2-methylpropan-1-amine

C14H21N — CID 114606308

IUPAC3-(2-cyclobutylphenyl)-2-methylpropan-1-amine
SMILESCC(CN)Cc1ccccc1C1CCC1
InChIInChI=1S/C14H21N/c1-11(10-15)9-13-5-2-3-8-14(13)12-6-4-7-12/h2-3,5,8,11-12H,4,6-7,9-10,15H2,1H3
InChIKeySGHILFHABNAECO-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.09
Rot. Bonds4

About 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine

3-(2-cyclobutylphenyl)-2-methylpropan-1-amine (PubChem CID 114606308) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(2-cyclobutylphenyl)-2-methylpropan-1-amine
PubChem CID114606308
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name3-(2-cyclobutylphenyl)-2-methylpropan-1-amine
SMILESCC(CN)Cc1ccccc1C1CCC1
InChIInChI=1S/C14H21N/c1-11(10-15)9-13-5-2-3-8-14(13)12-6-4-7-12/h2-3,5,8,11-12H,4,6-7,9-10,15H2,1H3
InChIKeySGHILFHABNAECO-UHFFFAOYSA-N
XLogP3.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-cyclopentylphenyl)propan-2-ol
CID 117292896
1-(2-cycloheptylphenyl)propan-2-ol
CID 117336946
O-[(2-cyclobutylphenyl)methyl]hydroxylamine
CID 117277584
2-(2-cycloheptylphenyl)ethanamine
CID 83836329
3-(2-cyclobutylphenyl)-1-phenylpropan-1-amine
CID 114606196
(3S)-3-amino-4-(2-cyclopropylphenyl)butan-2-one
CID 90076481
1-(2-bromoethyl)-2-cyclobutylbenzene
CID 114605787
(2R)-2-methyl-3-naphthalen-1-ylpropan-1-amine
CID 37134613
2-(aminomethyl)-3-(2-cyclopropylphenyl)-N-propylpropanamide
CID 79977413
1-cyclohexyl-2-(2-ethylhexyl)benzene
CID 154130996
3-(2-methoxyphenyl)-2-methylpropan-1-amine
CID 22024848
[2-(1-methylazepan-4-yl)phenyl]methanamine
CID 83836854

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine?
The IUPAC name of 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine (CID 114606308) is 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine.
What is the SMILES notation for 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine?
The canonical SMILES for 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine is CC(CN)Cc1ccccc1C1CCC1.
What is the InChIKey of 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine?
The InChIKey is SGHILFHABNAECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11(10-15)9-13-5-2-3-8-14(13)12-6-4-7-12/h2-3,5,8,11-12H,4,6-7,9-10,15H2,1H3.
What are the key properties of 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine?
3-(2-cyclobutylphenyl)-2-methylpropan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclobutylphenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 114606308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).