N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine

C8H17NO — CID 175701227

IUPACN,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
SMILESCN(C)C[C@H]1CCCOC1
InChIInChI=1S/C8H17NO/c1-9(2)6-8-4-3-5-10-7-8/h8H,3-7H2,1-2H3/t8-/m1/s1
InChIKeyUNCMMOXDNSVFRE-MRVPVSSYSA-N
MW143.23 g/mol
LogP0.97
Rot. Bonds2

About N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine

N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine (PubChem CID 175701227) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
PubChem CID175701227
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
SMILESCN(C)C[C@H]1CCCOC1
InChIInChI=1S/C8H17NO/c1-9(2)6-8-4-3-5-10-7-8/h8H,3-7H2,1-2H3/t8-/m1/s1
InChIKeyUNCMMOXDNSVFRE-MRVPVSSYSA-N
XLogP0.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(oxan-3-ylmethyl)hydroxylamine
CID 82594564
N-methyl-N-(oxan-3-ylmethyl)sulfamoyl chloride
CID 63726478
1-methyl-1-(oxan-3-ylmethyl)urea
CID 63712445
2-methyl-1-[methyl(oxan-3-ylmethyl)amino]propan-2-ol
CID 63713490
3-[[methyl(oxan-3-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 66010095
N-methyl-N-(oxan-3-ylmethyl)ethanimidamide
CID 63707795
2-[methyl(oxan-3-ylmethyl)amino]acetamide
CID 63713511
1-cyclobutyl-N,N-dimethylmethanamine
CID 4285302
3-amino-N-methyl-N-(oxan-3-ylmethyl)propanamide
CID 63712787
2-N-methyl-2-N-(oxan-3-ylmethyl)butane-1,2-diamine
CID 63725583
N-ethyl-N'-methyl-N'-(oxan-3-ylmethyl)ethane-1,2-diamine
CID 63727001
N'-methyl-N'-(oxan-3-ylmethyl)pentane-1,5-diamine
CID 63725582

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine (CID 175701227) is N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine is CN(C)C[C@H]1CCCOC1.
What is the InChIKey of N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine?
The InChIKey is UNCMMOXDNSVFRE-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H17NO/c1-9(2)6-8-4-3-5-10-7-8/h8H,3-7H2,1-2H3/t8-/m1/s1.
What are the key properties of N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine?
N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine has a molecular weight of 143.23 g/mol, XLogP of 0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine is sourced from PubChem (CID 175701227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).