2-(2-methylpyrrolidin-1-yl)ethanamine

C7H16N2 — CID 15154301

IUPAC2-(2-methylpyrrolidin-1-yl)ethanamine
SMILESCC1CCCN1CCN
InChIInChI=1S/C7H16N2/c1-7-3-2-5-9(7)6-4-8/h7H,2-6,8H2,1H3
InChIKeyCWCJURPRDOORGY-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.43
Rot. Bonds2

About 2-(2-methylpyrrolidin-1-yl)ethanamine

2-(2-methylpyrrolidin-1-yl)ethanamine (PubChem CID 15154301) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 2-(2-methylpyrrolidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2-methylpyrrolidin-1-yl)ethanamine
PubChem CID15154301
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name2-(2-methylpyrrolidin-1-yl)ethanamine
SMILESCC1CCCN1CCN
InChIInChI=1S/C7H16N2/c1-7-3-2-5-9(7)6-4-8/h7H,2-6,8H2,1H3
InChIKeyCWCJURPRDOORGY-UHFFFAOYSA-N
XLogP0.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrrolidin-1-yl)ethanamine?
The IUPAC name of 2-(2-methylpyrrolidin-1-yl)ethanamine (CID 15154301) is 2-(2-methylpyrrolidin-1-yl)ethanamine.
What is the SMILES notation for 2-(2-methylpyrrolidin-1-yl)ethanamine?
The canonical SMILES for 2-(2-methylpyrrolidin-1-yl)ethanamine is CC1CCCN1CCN.
What is the InChIKey of 2-(2-methylpyrrolidin-1-yl)ethanamine?
The InChIKey is CWCJURPRDOORGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-7-3-2-5-9(7)6-4-8/h7H,2-6,8H2,1H3.
What are the key properties of 2-(2-methylpyrrolidin-1-yl)ethanamine?
2-(2-methylpyrrolidin-1-yl)ethanamine has a molecular weight of 128.22 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrrolidin-1-yl)ethanamine is sourced from PubChem (CID 15154301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).