N-methyl-1-(oxan-2-yl)-1-phenylmethanamine

C13H19NO — CID 62213165

IUPACN-methyl-1-(oxan-2-yl)-1-phenylmethanamine
SMILESCNC(c1ccccc1)C1CCCCO1
InChIInChI=1S/C13H19NO/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-14H,5-6,9-10H2,1H3
InChIKeyXWZWXPYNISOHJE-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.52
Rot. Bonds3

About N-methyl-1-(oxan-2-yl)-1-phenylmethanamine

N-methyl-1-(oxan-2-yl)-1-phenylmethanamine (PubChem CID 62213165) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-methyl-1-(oxan-2-yl)-1-phenylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(oxan-2-yl)-1-phenylmethanamine
PubChem CID62213165
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-methyl-1-(oxan-2-yl)-1-phenylmethanamine
SMILESCNC(c1ccccc1)C1CCCCO1
InChIInChI=1S/C13H19NO/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-14H,5-6,9-10H2,1H3
InChIKeyXWZWXPYNISOHJE-UHFFFAOYSA-N
XLogP2.52
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[3-(2-methylpropyl)phenyl]-1-(oxan-2-yl)methanamine
CID 105050817
N-methyl-1-(oxan-2-yl)-1-(1-phenylpyrazol-4-yl)methanamine
CID 62212980
(1S,2R)-N-methyl-1-[(2S)-oxolan-2-yl]-2-phenylpropan-1-amine
CID 124705823
N-methyl-1-naphthalen-2-yl-1-(oxolan-2-yl)methanamine
CID 65328741
1-(3-fluorophenyl)-N-methyl-1-(oxolan-2-yl)methanamine
CID 65328286
4-methyl-N-[oxan-2-yl(phenyl)methyl]benzenesulfonamide
CID 101180255
1-(4-methoxyphenyl)-N-methyl-1-(oxolan-2-yl)methanamine
CID 43481680
1-(3-fluoro-4-methylphenyl)-N-methyl-1-(oxan-2-yl)methanamine
CID 107130447
2-(methylamino)-N-[oxolan-2-yl(phenyl)methyl]acetamide
CID 119757394
(1R)-N-methyl-1-[(2S)-oxolan-2-yl]-1-(4-phenyl-1,3-diazet-2-yl)methanamine
CID 155718502
1-[2,4-di(propan-2-yl)phenyl]-N-methyl-1-(oxan-2-yl)methanamine
CID 63509253
(2S)-2-[(1S)-1-phenylethyl]oxolane
CID 118374007

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(oxan-2-yl)-1-phenylmethanamine?
The IUPAC name of N-methyl-1-(oxan-2-yl)-1-phenylmethanamine (CID 62213165) is N-methyl-1-(oxan-2-yl)-1-phenylmethanamine.
What is the SMILES notation for N-methyl-1-(oxan-2-yl)-1-phenylmethanamine?
The canonical SMILES for N-methyl-1-(oxan-2-yl)-1-phenylmethanamine is CNC(c1ccccc1)C1CCCCO1.
What is the InChIKey of N-methyl-1-(oxan-2-yl)-1-phenylmethanamine?
The InChIKey is XWZWXPYNISOHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-14H,5-6,9-10H2,1H3.
What are the key properties of N-methyl-1-(oxan-2-yl)-1-phenylmethanamine?
N-methyl-1-(oxan-2-yl)-1-phenylmethanamine has a molecular weight of 205.30 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(oxan-2-yl)-1-phenylmethanamine is sourced from PubChem (CID 62213165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).