(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol

C7H15NO2 — CID 140507745

IUPAC(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol
SMILESCOC[C@H]1CN(C)C[C@@H]1O
InChIInChI=1S/C7H15NO2/c1-8-3-6(5-10-2)7(9)4-8/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKeyNZQBGDSCSPWZRD-RQJHMYQMSA-N
MW145.20 g/mol
LogP-0.44
Rot. Bonds2

About (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol

(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol (PubChem CID 140507745) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol
PubChem CID140507745
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol
SMILESCOC[C@H]1CN(C)C[C@@H]1O
InChIInChI=1S/C7H15NO2/c1-8-3-6(5-10-2)7(9)4-8/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKeyNZQBGDSCSPWZRD-RQJHMYQMSA-N
XLogP-0.44
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-butyl-1-methylpyrrolidin-3-ol
CID 140584543
(3S,4R)-4-(ethylsulfanylmethyl)-1-methylpyrrolidin-3-ol
CID 140545349
3-(methoxymethyl)-1,4-dimethylpiperidine
CID 170079512
4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol
CID 145293090
4-(methoxymethyl)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 134400428
(3aS,4R,6aR)-4-(methoxymethyl)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 134400253
(3R,4R,5R)-5-(hydroxymethyl)-1-methylpiperidine-3,4-diol;hydrochloride
CID 172714934
4-(methoxymethyl)cyclopentane-1,3-diol
CID 174518927
1-(4-hydroxy-1-methylpyrrolidin-3-yl)ethanone
CID 59878538
(3R,4R,5R)-1-tert-butyl-5-(methoxymethyl)piperidine-3,4-diol
CID 172518164
2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
CID 64582386
(1S,2S,4R)-2-(methoxymethyl)-4-methylcyclopentan-1-ol
CID 58944642

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol?
The IUPAC name of (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol (CID 140507745) is (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol.
What is the SMILES notation for (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol?
The canonical SMILES for (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol is COC[C@H]1CN(C)C[C@@H]1O.
What is the InChIKey of (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol?
The InChIKey is NZQBGDSCSPWZRD-RQJHMYQMSA-N. The full InChI is InChI=1S/C7H15NO2/c1-8-3-6(5-10-2)7(9)4-8/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1.
What are the key properties of (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol?
(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol has a molecular weight of 145.20 g/mol, XLogP of -0.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol is sourced from PubChem (CID 140507745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).