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

C6H15NO — CID 142806903

IUPACN-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen
SMILESCNC[C@H]1CCCO1.[H][H]
InChIInChI=1S/C6H13NO.H2/c1-7-5-6-3-2-4-8-6;/h6-7H,2-5H2,1H3;1H/t6-;/m1./s1
InChIKeyUKECMZNMYVNLHY-FYZOBXCZSA-N
MW117.19 g/mol
LogP0.63
Rot. Bonds2

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

N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen (PubChem CID 142806903) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen.

Molecular Properties

Compound NameN-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen
PubChem CID142806903
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC NameN-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen
SMILESCNC[C@H]1CCCO1.[H][H]
InChIInChI=1S/C6H13NO.H2/c1-7-5-6-3-2-4-8-6;/h6-7H,2-5H2,1H3;1H/t6-;/m1./s1
InChIKeyUKECMZNMYVNLHY-FYZOBXCZSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N-methyl-1-(oxolan-2-yl)methanamine
CID 91079378
1-N-methyl-4-N-(oxolan-2-ylmethyl)cyclohexane-1,4-diamine
CID 117027418
N-methyl-1-[2-[2-(oxolan-2-yl)ethyl]cyclopentyl]methanamine
CID 81034767
N-(oxolan-2-ylmethyl)propan-2-amine;hydrochloride
CID 172772952
N-(oxiran-2-ylmethyl)-1-(oxolan-2-yl)methanamine
CID 126662658
[(2R)-oxolan-2-yl]methylhydrazine;dihydrochloride
CID 66643106
3-(methylamino)-N-(oxolan-2-ylmethyl)propanamide
CID 54773627
3,5-dimethyl-N-(oxan-2-ylmethyl)cyclohexan-1-amine
CID 64751038
N,3,3-trimethyl-5-(oxolan-2-yl)pentan-1-amine
CID 81022159
(2S,6S)-2,6-dimethyl-N-[[(2S)-oxolan-2-yl]methyl]oxan-4-amine
CID 97358325
[(2S)-oxolan-2-yl]methylcyanamide
CID 87337063
1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
CID 3607647

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen?
The IUPAC name of N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen (CID 142806903) is N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen.
What is the SMILES notation for N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen?
The canonical SMILES for N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen is CNC[C@H]1CCCO1.[H][H].
What is the InChIKey of N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen?
The InChIKey is UKECMZNMYVNLHY-FYZOBXCZSA-N. The full InChI is InChI=1S/C6H13NO.H2/c1-7-5-6-3-2-4-8-6;/h6-7H,2-5H2,1H3;1H/t6-;/m1./s1.
What are the key properties of N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen?
N-methyl-1-[(2R)-oxolan-2-yl]methanamine;molecular hydrogen has a molecular weight of 117.19 g/mol, XLogP of 0.63, 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;molecular hydrogen is sourced from PubChem (CID 142806903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).