1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine

C11H24N2 — CID 117017786

IUPAC1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine
SMILESCCCN1CCC(CNC)C1(C)C
InChIInChI=1S/C11H24N2/c1-5-7-13-8-6-10(9-12-4)11(13,2)3/h10,12H,5-9H2,1-4H3
InChIKeyBPYTYYRRZZMVNK-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.72
Rot. Bonds4

About 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine

1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine (PubChem CID 117017786) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine
PubChem CID117017786
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine
SMILESCCCN1CCC(CNC)C1(C)C
InChIInChI=1S/C11H24N2/c1-5-7-13-8-6-10(9-12-4)11(13,2)3/h10,12H,5-9H2,1-4H3
InChIKeyBPYTYYRRZZMVNK-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine (CID 117017786) is 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine is CCCN1CCC(CNC)C1(C)C.
What is the InChIKey of 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine?
The InChIKey is BPYTYYRRZZMVNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-7-13-8-6-10(9-12-4)11(13,2)3/h10,12H,5-9H2,1-4H3.
What are the key properties of 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine?
1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine has a molecular weight of 184.33 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethyl-1-propylpyrrolidin-3-yl)-N-methylmethanamine is sourced from PubChem (CID 117017786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).