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

C6H13NO — CID 30427580

IUPACN-methyl-1-[(3R)-oxolan-3-yl]methanamine
SMILESCNC[C@H]1CCOC1
InChIInChI=1S/C6H13NO/c1-7-4-6-2-3-8-5-6/h6-7H,2-5H2,1H3/t6-/m1/s1
InChIKeyZUGRRINNTXSWBR-ZCFIWIBFSA-N
MW115.18 g/mol
LogP0.24
Rot. Bonds2

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

N-methyl-1-[(3R)-oxolan-3-yl]methanamine (PubChem CID 30427580) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is N-methyl-1-[(3R)-oxolan-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[(3R)-oxolan-3-yl]methanamine
PubChem CID30427580
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC NameN-methyl-1-[(3R)-oxolan-3-yl]methanamine
SMILESCNC[C@H]1CCOC1
InChIInChI=1S/C6H13NO/c1-7-4-6-2-3-8-5-6/h6-7H,2-5H2,1H3/t6-/m1/s1
InChIKeyZUGRRINNTXSWBR-ZCFIWIBFSA-N
XLogP0.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(oxan-4-yl)methanamine
CID 22225668
2-methyl-3-(methylamino)-N-(oxolan-3-ylmethyl)propanamide;hydrochloride
CID 119716813
N-methyl-1-[1-(oxolan-3-ylmethyl)piperidin-3-yl]methanamine
CID 61204128
N-[[(3S)-oxolan-3-yl]methyl]cyclopropanamine
CID 30427697
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
2-methyl-N-(oxolan-3-ylmethyl)propanamide
CID 60757135
2-methyl-N-(oxolan-3-ylmethyl)butan-1-amine
CID 60919551
3-ethyloxolane
CID 10996972
2-chloro-N-(oxolan-3-ylmethyl)propan-1-amine
CID 65024238
N-methyl-1-(3-oxabicyclo[4.1.0]heptan-7-yl)methanamine
CID 84648667
1-methylsulfanyl-N-(oxolan-3-ylmethyl)ethanamine
CID 134457089
2-methoxy-N-(oxolan-3-ylmethyl)ethanamine
CID 43190181

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(3R)-oxolan-3-yl]methanamine?
The IUPAC name of N-methyl-1-[(3R)-oxolan-3-yl]methanamine (CID 30427580) is N-methyl-1-[(3R)-oxolan-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[(3R)-oxolan-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[(3R)-oxolan-3-yl]methanamine is CNC[C@H]1CCOC1.
What is the InChIKey of N-methyl-1-[(3R)-oxolan-3-yl]methanamine?
The InChIKey is ZUGRRINNTXSWBR-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H13NO/c1-7-4-6-2-3-8-5-6/h6-7H,2-5H2,1H3/t6-/m1/s1.
What are the key properties of N-methyl-1-[(3R)-oxolan-3-yl]methanamine?
N-methyl-1-[(3R)-oxolan-3-yl]methanamine has a molecular weight of 115.18 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(3R)-oxolan-3-yl]methanamine is sourced from PubChem (CID 30427580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).