1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine

C15H21N — CID 79979705

IUPAC1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine
SMILESc1cc(CNCC2CCC2)cc(C2CC2)c1
InChIInChI=1S/C15H21N/c1-3-12(4-1)10-16-11-13-5-2-6-15(9-13)14-7-8-14/h2,5-6,9,12,14,16H,1,3-4,7-8,10-11H2
InChIKeyFKMGMSCHCATQSP-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.45
Rot. Bonds5

About 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine

1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine (PubChem CID 79979705) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine
PubChem CID79979705
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine
SMILESc1cc(CNCC2CCC2)cc(C2CC2)c1
InChIInChI=1S/C15H21N/c1-3-12(4-1)10-16-11-13-5-2-6-15(9-13)14-7-8-14/h2,5-6,9,12,14,16H,1,3-4,7-8,10-11H2
InChIKeyFKMGMSCHCATQSP-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-N-[(3-cyclopropylphenyl)methyl]methanamine
CID 79978912
4-[[(3-cyclopropylphenyl)methylamino]methyl]cyclohexane-1-carboxylic acid
CID 79971547
N-[(3-bromophenyl)methyl]-1-cyclobutylmethanamine
CID 43298546
1-cyclobutyl-N-[(3-methoxyphenyl)methyl]methanamine
CID 43298537
3-[(cyclobutylmethylamino)methyl]-N-methylaniline
CID 115212230
N-[(3-bromophenyl)methyl]-1-cyclohexylmethanamine
CID 43215546
1-cyclopentyl-N-[(4-cyclopropylphenyl)methyl]methanamine
CID 79978986
N-benzyl-1-cyclobutylmethanamine;methanol
CID 170726729
N-[(3-cyclopropylphenyl)methyl]-1-(4-ethylphenyl)methanamine
CID 106899392
N-[(3-cyclopropylphenyl)methyl]-2-methoxy-2-methylpropan-1-amine
CID 113450002
N-[(3-cyclopropylphenyl)methyl]cyclopentanamine
CID 79979605
4-[(cyclobutylmethylamino)methyl]benzene-1,2-diol
CID 43298488

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine?
The IUPAC name of 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine (CID 79979705) is 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine.
What is the SMILES notation for 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine?
The canonical SMILES for 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine is c1cc(CNCC2CCC2)cc(C2CC2)c1.
What is the InChIKey of 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine?
The InChIKey is FKMGMSCHCATQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-3-12(4-1)10-16-11-13-5-2-6-15(9-13)14-7-8-14/h2,5-6,9,12,14,16H,1,3-4,7-8,10-11H2.
What are the key properties of 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine?
1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine has a molecular weight of 215.34 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-[(3-cyclopropylphenyl)methyl]methanamine is sourced from PubChem (CID 79979705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).