2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine

C10H22N2O — CID 102776271

IUPAC2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine
SMILESCOC(C)CNCC1NCCC1C
InChIInChI=1S/C10H22N2O/c1-8-4-5-12-10(8)7-11-6-9(2)13-3/h8-12H,4-7H2,1-3H3
InChIKeyDXGKPEXKGKASPR-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.61
Rot. Bonds5

About 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine

2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine (PubChem CID 102776271) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine
PubChem CID102776271
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine
SMILESCOC(C)CNCC1NCCC1C
InChIInChI=1S/C10H22N2O/c1-8-4-5-12-10(8)7-11-6-9(2)13-3/h8-12H,4-7H2,1-3H3
InChIKeyDXGKPEXKGKASPR-UHFFFAOYSA-N
XLogP0.61
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2-Methoxyethyl)(methyl)((pyrrolidin-2-yl)methyl)amine
CID 50989303
(((2S,4S)-4-methoxypyrrolidin-2-yl)methyl)dimethylamine
CID 93629690
{[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl}(methyl)amine
CID 121552283
ethane;2-(trifluoromethoxy)-N-[[3-(trifluoromethyl)pyrrolidin-2-yl]methyl]ethanamine
CID 172334266
N-methyl-N-[(3-methylpyrrolidin-2-yl)methyl]-2-(trifluoromethoxy)ethanamine
CID 172334325
N-ethyl-2-(trifluoromethoxy)-N-[[3-(trifluoromethyl)pyrrolidin-2-yl]methyl]ethanamine
CID 172334627
ethane;N-methyl-2-(trifluoromethoxy)-N-[[3-(trifluoromethyl)pyrrolidin-2-yl]methyl]ethanamine
CID 172334839
N-[(4-methylpyrrolidin-2-yl)methyl]-2-(trifluoromethoxy)ethanamine
CID 172335350
[3-Methyl-1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]methanamine
CID 102784485
N-methyl-2-(trifluoromethoxy)-N-[[3-(trifluoromethyl)pyrrolidin-2-yl]methyl]ethanamine
CID 172334840
(4-Propan-2-yloxypyrrolidin-2-yl)methanamine
CID 17920485
4-methoxy-N,5-dimethylpyrrolidin-3-amine
CID 19969876

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
The IUPAC name of 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine (CID 102776271) is 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
The canonical SMILES for 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine is COC(C)CNCC1NCCC1C.
What is the InChIKey of 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
The InChIKey is DXGKPEXKGKASPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-8-4-5-12-10(8)7-11-6-9(2)13-3/h8-12H,4-7H2,1-3H3.
What are the key properties of 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine?
2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine has a molecular weight of 186.30 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(3-methylpyrrolidin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 102776271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).