1-(2-benzyloxolan-3-yl)-N-methylmethanamine

C13H19NO — CID 79368511

IUPAC1-(2-benzyloxolan-3-yl)-N-methylmethanamine
SMILESCNCC1CCOC1Cc1ccccc1
InChIInChI=1S/C13H19NO/c1-14-10-12-7-8-15-13(12)9-11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3
InChIKeyKGFCOCWHYOBCPX-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.85
Rot. Bonds4

About 1-(2-benzyloxolan-3-yl)-N-methylmethanamine

1-(2-benzyloxolan-3-yl)-N-methylmethanamine (PubChem CID 79368511) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(2-benzyloxolan-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-benzyloxolan-3-yl)-N-methylmethanamine
PubChem CID79368511
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(2-benzyloxolan-3-yl)-N-methylmethanamine
SMILESCNCC1CCOC1Cc1ccccc1
InChIInChI=1S/C13H19NO/c1-14-10-12-7-8-15-13(12)9-11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3
InChIKeyKGFCOCWHYOBCPX-UHFFFAOYSA-N
XLogP1.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-benzyloxolan-3-yl)methyl]ethanamine
CID 79368716
(2-benzyloxolan-3-yl)methanamine
CID 79368410
2-benzyloxolane-3-carbonitrile
CID 79368490
N-methyl-1-[2-(4-phenylphenyl)oxolan-3-yl]methanamine
CID 79367575
1-[(3S,4S)-4-benzylpyrrolidin-3-yl]-N-methylmethanamine
CID 68835618
(2-benzyloxan-3-yl)methanamine
CID 79367759
(3aR,4S,7aS)-4-benzyl-3,3a,4,6,7,7a-hexahydro-2H-furo[3,2-c]pyran
CID 45277508
N-methyl-1-[2-(2-phenylpropyl)oxan-3-yl]methanamine
CID 79365896
(2S,3S)-3-benzyloxolan-2-ol
CID 86339403
N-methyl-1-[2-(2-methylpropyl)oxolan-3-yl]methanamine
CID 79368608
(2R,3S)-3-ethyl-2-[(4-methylphenyl)methyl]oxolane
CID 11481131
1-[2-(1-benzofuran-2-yl)oxolan-3-yl]-N-methylmethanamine
CID 79367665

Frequently Asked Questions

What is the IUPAC name of 1-(2-benzyloxolan-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(2-benzyloxolan-3-yl)-N-methylmethanamine (CID 79368511) is 1-(2-benzyloxolan-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-benzyloxolan-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2-benzyloxolan-3-yl)-N-methylmethanamine is CNCC1CCOC1Cc1ccccc1.
What is the InChIKey of 1-(2-benzyloxolan-3-yl)-N-methylmethanamine?
The InChIKey is KGFCOCWHYOBCPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-14-10-12-7-8-15-13(12)9-11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3.
What are the key properties of 1-(2-benzyloxolan-3-yl)-N-methylmethanamine?
1-(2-benzyloxolan-3-yl)-N-methylmethanamine has a molecular weight of 205.30 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-benzyloxolan-3-yl)-N-methylmethanamine is sourced from PubChem (CID 79368511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).