1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine

C16H24N2O — CID 115765831

IUPAC1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine
SMILESCC1(NCc2ccc(N3CCOCC3)cc2)CCC1
InChIInChI=1S/C16H24N2O/c1-16(7-2-8-16)17-13-14-3-5-15(6-4-14)18-9-11-19-12-10-18/h3-6,17H,2,7-13H2,1H3
InChIKeySANWAGMZJWBFSU-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.56
Rot. Bonds4

About 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine

1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine (PubChem CID 115765831) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine
PubChem CID115765831
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine
SMILESCC1(NCc2ccc(N3CCOCC3)cc2)CCC1
InChIInChI=1S/C16H24N2O/c1-16(7-2-8-16)17-13-14-3-5-15(6-4-14)18-9-11-19-12-10-18/h3-6,17H,2,7-13H2,1H3
InChIKeySANWAGMZJWBFSU-UHFFFAOYSA-N
XLogP2.56
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine 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

4-methyl-N-[(4-morpholin-4-ylphenyl)methyl]oxan-4-amine
CID 115758040
N-[(4-morpholin-4-ylphenyl)methyl]but-2-yn-1-amine
CID 113342036
4-methyl-N-[(4-phenylphenyl)methyl]oxan-4-amine
CID 115758046
N-[[4-(dimethylamino)phenyl]methyl]-4-methyloxan-4-amine
CID 113321797
1-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine
CID 61365748
(2R)-2-[(4-morpholin-4-ylphenyl)methylamino]propan-1-ol
CID 93082442
4-(4-ethylphenyl)morpholine
CID 20576442
N-[(3-methyloxetan-3-yl)methyl]-1-(4-pyrrolidin-1-ylphenyl)methanamine
CID 78957539
(E)-N-[(4-morpholin-4-ylphenyl)methyl]pent-3-en-1-amine
CID 115629182
1-(3,5-dimethylphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutane-1-carboxamide
CID 75417030
N',3,3-trimethyl-N-[(4-morpholin-4-ylphenyl)methyl]pyrrolidine-1-carboximidamide
CID 111739118
3-methyl-1-[(4-morpholin-4-ylphenyl)methylamino]butan-2-ol
CID 111422027

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine?
The IUPAC name of 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine (CID 115765831) is 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine?
The canonical SMILES for 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine is CC1(NCc2ccc(N3CCOCC3)cc2)CCC1.
What is the InChIKey of 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine?
The InChIKey is SANWAGMZJWBFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-16(7-2-8-16)17-13-14-3-5-15(6-4-14)18-9-11-19-12-10-18/h3-6,17H,2,7-13H2,1H3.
What are the key properties of 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine?
1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine has a molecular weight of 260.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 115765831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).