1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine

C17H26N2O — CID 63155325

IUPAC1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine
SMILESc1ccc(C2(CNCC3CCOC3)CCNCC2)cc1
InChIInChI=1S/C17H26N2O/c1-2-4-16(5-3-1)17(7-9-18-10-8-17)14-19-12-15-6-11-20-13-15/h1-5,15,18-19H,6-14H2
InChIKeyOEWJLXUEXBGUQS-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.93
Rot. Bonds5

About 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine

1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine (PubChem CID 63155325) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine
PubChem CID63155325
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine
SMILESc1ccc(C2(CNCC3CCOC3)CCNCC2)cc1
InChIInChI=1S/C17H26N2O/c1-2-4-16(5-3-1)17(7-9-18-10-8-17)14-19-12-15-6-11-20-13-15/h1-5,15,18-19H,6-14H2
InChIKeyOEWJLXUEXBGUQS-UHFFFAOYSA-N
XLogP1.93
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]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

N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine
CID 62825418
(3R)-N-[(1-phenylcyclopentyl)methyl]oxolan-3-amine
CID 124513857
N',N'-dimethyl-N-[(4-phenylpiperidin-4-yl)methyl]ethane-1,2-diamine
CID 143792201
1-[(oxolan-3-ylmethylamino)methyl]cyclopropan-1-amine
CID 65457971
N-(oxolan-3-ylmethyl)-1-pyrrolidin-3-ylmethanamine
CID 63006355
(3S)-N-[(1-phenylcyclopentyl)methyl]oxolane-3-carboxamide
CID 95272452
2-[(3S)-oxolan-3-yl]-N-(4-phenyloxan-4-yl)acetamide
CID 125440939
3-methyl-N-(oxolan-3-ylmethyl)-2-phenylbutan-1-amine
CID 103896914
1,2-dimethyl-1-(oxolan-3-ylmethyl)-3-[(1-phenylcyclopentyl)methyl]guanidine;hydroiodide
CID 109384582
N-[(1-methylcyclobutyl)methyl]-1-(oxolan-3-yl)methanamine
CID 115887835
2-methyl-1-[3-(oxolan-3-ylmethoxy)propyl]-3-[(1-phenylcyclobutyl)methyl]guanidine
CID 111648240
N-(oxolan-3-ylmethyl)-3-phenylprop-2-en-1-amine
CID 76940224

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine?
The IUPAC name of 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine (CID 63155325) is 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine.
What is the SMILES notation for 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine?
The canonical SMILES for 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine is c1ccc(C2(CNCC3CCOC3)CCNCC2)cc1.
What is the InChIKey of 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine?
The InChIKey is OEWJLXUEXBGUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-4-16(5-3-1)17(7-9-18-10-8-17)14-19-12-15-6-11-20-13-15/h1-5,15,18-19H,6-14H2.
What are the key properties of 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine?
1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine has a molecular weight of 274.41 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)-N-[(4-phenylpiperidin-4-yl)methyl]methanamine is sourced from PubChem (CID 63155325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).