N-methyl-1-[(2R)-oxolan-2-yl]methanamine

C6H13NO — CID 41098313

IUPACN-methyl-1-[(2R)-oxolan-2-yl]methanamine
SMILESCNC[C@H]1CCCO1
InChIInChI=1S/C6H13NO/c1-7-5-6-3-2-4-8-6/h6-7H,2-5H2,1H3/t6-/m1/s1
InChIKeyVJUDVVHGQMPPEI-ZCFIWIBFSA-N
MW115.18 g/mol
LogP0.38
Rot. Bonds2

About N-methyl-1-[(2R)-oxolan-2-yl]methanamine

N-methyl-1-[(2R)-oxolan-2-yl]methanamine (PubChem CID 41098313) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is N-methyl-1-[(2R)-oxolan-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[(2R)-oxolan-2-yl]methanamine
PubChem CID41098313
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC NameN-methyl-1-[(2R)-oxolan-2-yl]methanamine
SMILESCNC[C@H]1CCCO1
InChIInChI=1S/C6H13NO/c1-7-5-6-3-2-4-8-6/h6-7H,2-5H2,1H3/t6-/m1/s1
InChIKeyVJUDVVHGQMPPEI-ZCFIWIBFSA-N
XLogP0.38
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 ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2R)-oxolan-2-yl]methanamine?
The IUPAC name of N-methyl-1-[(2R)-oxolan-2-yl]methanamine (CID 41098313) is N-methyl-1-[(2R)-oxolan-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[(2R)-oxolan-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[(2R)-oxolan-2-yl]methanamine is CNC[C@H]1CCCO1.
What is the InChIKey of N-methyl-1-[(2R)-oxolan-2-yl]methanamine?
The InChIKey is VJUDVVHGQMPPEI-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H13NO/c1-7-5-6-3-2-4-8-6/h6-7H,2-5H2,1H3/t6-/m1/s1.
What are the key properties of N-methyl-1-[(2R)-oxolan-2-yl]methanamine?
N-methyl-1-[(2R)-oxolan-2-yl]methanamine has a molecular weight of 115.18 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2R)-oxolan-2-yl]methanamine is sourced from PubChem (CID 41098313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).