(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine

C18H21NO — CID 116505877

IUPAC(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
SMILESCOc1ccc(C(N)c2ccc(C3CCC3)cc2)cc1
InChIInChI=1S/C18H21NO/c1-20-17-11-9-16(10-12-17)18(19)15-7-5-14(6-8-15)13-3-2-4-13/h5-13,18H,2-4,19H2,1H3
InChIKeyKRCZZDJFHPHLAL-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.01
Rot. Bonds4

About (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine

(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine (PubChem CID 116505877) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine.

Molecular Properties

Compound Name(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
PubChem CID116505877
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
SMILESCOc1ccc(C(N)c2ccc(C3CCC3)cc2)cc1
InChIInChI=1S/C18H21NO/c1-20-17-11-9-16(10-12-17)18(19)15-7-5-14(6-8-15)13-3-2-4-13/h5-13,18H,2-4,19H2,1H3
InChIKeyKRCZZDJFHPHLAL-UHFFFAOYSA-N
XLogP4.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
CID 114602513
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
(4-cyclobutylphenyl)-(4-fluoro-3-methoxyphenyl)methanamine
CID 105044855
(4-cyclobutylphenyl)-(4-fluorophenyl)methanamine
CID 116505887
(4-cyclohexylphenyl)-(4-methoxythiophen-2-yl)methanamine
CID 81121687
1-cyclohexyl-4-(4-methoxyphenyl)benzene;ethene
CID 144983864
(4-chloro-3-methylphenyl)-(4-cyclobutylphenyl)methanamine
CID 105044946
[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine
CID 24738284
(4S)-4-(4-methoxyphenyl)azepane
CID 95439149
1-[4-(4-methoxyphenyl)cyclohexyl]propan-1-amine
CID 126586754
2-cyclopentyl-6-methoxynaphthalene
CID 67100251
1-(4-cyclobutylphenyl)-2-methylbutan-1-amine
CID 116506106

Frequently Asked Questions

What is the IUPAC name of (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine?
The IUPAC name of (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine (CID 116505877) is (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine.
What is the SMILES notation for (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine?
The canonical SMILES for (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine is COc1ccc(C(N)c2ccc(C3CCC3)cc2)cc1.
What is the InChIKey of (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine?
The InChIKey is KRCZZDJFHPHLAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-20-17-11-9-16(10-12-17)18(19)15-7-5-14(6-8-15)13-3-2-4-13/h5-13,18H,2-4,19H2,1H3.
What are the key properties of (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine?
(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine has a molecular weight of 267.37 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine is sourced from PubChem (CID 116505877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).