1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine

C11H22N2 — CID 102776216

IUPAC1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine
SMILESCC1CC1CNCC1NCCC1C
InChIInChI=1S/C11H22N2/c1-8-3-4-13-11(8)7-12-6-10-5-9(10)2/h8-13H,3-7H2,1-2H3
InChIKeyJGOFYHWHTFWLRC-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.23
Rot. Bonds4

About 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine

1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine (PubChem CID 102776216) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine
PubChem CID102776216
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine
SMILESCC1CC1CNCC1NCCC1C
InChIInChI=1S/C11H22N2/c1-8-3-4-13-11(8)7-12-6-10-5-9(10)2/h8-13H,3-7H2,1-2H3
InChIKeyJGOFYHWHTFWLRC-UHFFFAOYSA-N
XLogP1.23
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine?
The IUPAC name of 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine (CID 102776216) is 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine is CC1CC1CNCC1NCCC1C.
What is the InChIKey of 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine?
The InChIKey is JGOFYHWHTFWLRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-8-3-4-13-11(8)7-12-6-10-5-9(10)2/h8-13H,3-7H2,1-2H3.
What are the key properties of 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine?
1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine has a molecular weight of 182.31 g/mol, XLogP of 1.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopropyl)-N-[(3-methylpyrrolidin-2-yl)methyl]methanamine is sourced from PubChem (CID 102776216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).