N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine

C7H16N2O — CID 105428686

IUPACN-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine
SMILESCN(O)CCC1CCNC1
InChIInChI=1S/C7H16N2O/c1-9(10)5-3-7-2-4-8-6-7/h7-8,10H,2-6H2,1H3
InChIKeyAEXCULAUHHPEBH-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.31
Rot. Bonds3

About N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine

N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine (PubChem CID 105428686) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine
PubChem CID105428686
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC NameN-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine
SMILESCN(O)CCC1CCNC1
InChIInChI=1S/C7H16N2O/c1-9(10)5-3-7-2-4-8-6-7/h7-8,10H,2-6H2,1H3
InChIKeyAEXCULAUHHPEBH-UHFFFAOYSA-N
XLogP0.31
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(1-hydroxy-2,2,5,5-tetramethylpyrrolidin-3-yl)-N-methylmethanamine
CID 11853022
3-Ethylpyrrolidine;methanamine
CID 19046047
3-ethylpyrrolidine;N-methylmethanamine
CID 19046058
N-ethyl-2-(pyrrolidin-3-yl)ethanamine
CID 20188156
N-methyl-2-(pyrrolidin-3-yl)ethanamine
CID 22601804
(3S)-3-ethylpyrrolidine;N-methylmethanamine
CID 67553104
2-[(1-hydroxypyrrolidin-3-yl)methyl]-N-methylpentan-1-amine
CID 67674190
N-ethyl-2-[(3S)-pyrrolidin-3-yl]ethanamine
CID 70113644
N-methyl-2-[(3S)-pyrrolidin-3-yl]ethanamine
CID 70115619
N-methyl-2-[(3R)-pyrrolidin-3-yl]ethanamine
CID 70133992
1-Hydroxy-4-propan-2-ylpyrrolidin-2-amine
CID 70140810
(3R)-3-ethylpyrrolidine;N-methylmethanamine
CID 70347140

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine?
The IUPAC name of N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine (CID 105428686) is N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine.
What is the SMILES notation for N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine?
The canonical SMILES for N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine is CN(O)CCC1CCNC1.
What is the InChIKey of N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine?
The InChIKey is AEXCULAUHHPEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-9(10)5-3-7-2-4-8-6-7/h7-8,10H,2-6H2,1H3.
What are the key properties of N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine?
N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine has a molecular weight of 144.22 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyrrolidin-3-ylethyl)hydroxylamine is sourced from PubChem (CID 105428686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).