N,N-diethyl-1-methylpyrrolidin-3-amine

C9H20N2 — CID 20736569

IUPACN,N-diethyl-1-methylpyrrolidin-3-amine
SMILESCCN(CC)C1CCN(C)C1
InChIInChI=1S/C9H20N2/c1-4-11(5-2)9-6-7-10(3)8-9/h9H,4-8H2,1-3H3
InChIKeyBKFTWDIFIATCFK-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.03
Rot. Bonds3

About N,N-diethyl-1-methylpyrrolidin-3-amine

N,N-diethyl-1-methylpyrrolidin-3-amine (PubChem CID 20736569) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N,N-diethyl-1-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-1-methylpyrrolidin-3-amine
PubChem CID20736569
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN,N-diethyl-1-methylpyrrolidin-3-amine
SMILESCCN(CC)C1CCN(C)C1
InChIInChI=1S/C9H20N2/c1-4-11(5-2)9-6-7-10(3)8-9/h9H,4-8H2,1-3H3
InChIKeyBKFTWDIFIATCFK-UHFFFAOYSA-N
XLogP1.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Diethylamino)pyrrolidine
CID 19961995
N,N-Dimethyl-2-(pyrrolidin-1-yl)ethan-1-amine
CID 23423571
1-(Pyrrolidin-1-yl)butan-2-amine
CID 6484668
N,1-Diethylpyrrolidin-3-amine
CID 14153712
2-(Pyrrolidin-1-yl)butan-1-amine
CID 16781670
N,N-dimethyl-1-(prop-2-yn-1-yl)pyrrolidin-3-amine
CID 63164590
1-(Butan-2-yl)pyrrolidine
CID 12773423
1-(Propan-2-yl)pyrrolidin-3-amine
CID 16244563
N-ethyl-4-fluoro-1-methyl-N-propan-2-ylpyrrolidin-3-amine
CID 59289511
5-(fluoromethyl)-1-methyl-N,N-di(propan-2-yl)pyrrolidin-3-amine
CID 59289523
5-(fluoromethyl)-N,1-dimethyl-N-propan-2-ylpyrrolidin-3-amine
CID 59289535
N-ethyl-5-(fluoromethyl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine
CID 59289554

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-methylpyrrolidin-3-amine?
The IUPAC name of N,N-diethyl-1-methylpyrrolidin-3-amine (CID 20736569) is N,N-diethyl-1-methylpyrrolidin-3-amine.
What is the SMILES notation for N,N-diethyl-1-methylpyrrolidin-3-amine?
The canonical SMILES for N,N-diethyl-1-methylpyrrolidin-3-amine is CCN(CC)C1CCN(C)C1.
What is the InChIKey of N,N-diethyl-1-methylpyrrolidin-3-amine?
The InChIKey is BKFTWDIFIATCFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-4-11(5-2)9-6-7-10(3)8-9/h9H,4-8H2,1-3H3.
What are the key properties of N,N-diethyl-1-methylpyrrolidin-3-amine?
N,N-diethyl-1-methylpyrrolidin-3-amine has a molecular weight of 156.27 g/mol, XLogP of 1.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-methylpyrrolidin-3-amine is sourced from PubChem (CID 20736569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).