1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine

C9H20N2 — CID 20728507

IUPAC1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine
SMILESCC1CN(C)CC1CN(C)C
InChIInChI=1S/C9H20N2/c1-8-5-11(4)7-9(8)6-10(2)3/h8-9H,5-7H2,1-4H3
InChIKeySBZLMRMHHJWQJW-UHFFFAOYSA-N
MW156.27 g/mol
LogP0.75
Rot. Bonds2

About 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine

1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine (PubChem CID 20728507) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine
PubChem CID20728507
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine
SMILESCC1CN(C)CC1CN(C)C
InChIInChI=1S/C9H20N2/c1-8-5-11(4)7-9(8)6-10(2)3/h8-9H,5-7H2,1-4H3
InChIKeySBZLMRMHHJWQJW-UHFFFAOYSA-N
XLogP0.75
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine (CID 20728507) is 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine is CC1CN(C)CC1CN(C)C.
What is the InChIKey of 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
The InChIKey is SBZLMRMHHJWQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8-5-11(4)7-9(8)6-10(2)3/h8-9H,5-7H2,1-4H3.
What are the key properties of 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine?
1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine has a molecular weight of 156.27 g/mol, XLogP of 0.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dimethylpyrrolidin-3-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 20728507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).