N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine

C13H29N3 — CID 63166631

IUPACN,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine
SMILESCCN(CC)C1CCN(CC(C)CNC)C1
InChIInChI=1S/C13H29N3/c1-5-16(6-2)13-7-8-15(11-13)10-12(3)9-14-4/h12-14H,5-11H2,1-4H3
InChIKeyGTPQSCDRBYXNSY-UHFFFAOYSA-N
MW227.40 g/mol
LogP1.26
Rot. Bonds7

About N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine

N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine (PubChem CID 63166631) has the molecular formula C13H29N3 and a molecular weight of 227.40 g/mol. Its IUPAC name is N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine
PubChem CID63166631
Molecular FormulaC13H29N3
Molecular Weight227.40 g/mol
Exact Mass227.24
IUPAC NameN,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine
SMILESCCN(CC)C1CCN(CC(C)CNC)C1
InChIInChI=1S/C13H29N3/c1-5-16(6-2)13-7-8-15(11-13)10-12(3)9-14-4/h12-14H,5-11H2,1-4H3
InChIKeyGTPQSCDRBYXNSY-UHFFFAOYSA-N
XLogP1.26
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.40
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(cyclopropylamino)-2-methylpropyl]-N,N-diethylpyrrolidin-3-amine
CID 63166714
1-(3-bromo-2-methylpropyl)-N,N-diethylpyrrolidin-3-amine
CID 64995050
1-(2,2-dimethoxyethyl)-N,N-diethylpyrrolidin-3-amine
CID 66223207
3-methyl-1-[2-methyl-3-(methylamino)propyl]piperidin-4-ol
CID 114681091
N,N-diethyl-1-[3-(methylamino)propyl]pyrrolidin-3-amine
CID 63164683
N,N-diethyl-1-[2-(ethylamino)pentyl]pyrrolidin-3-amine
CID 55160900
1-bromo-3-[3-(diethylamino)pyrrolidin-1-yl]propan-2-ol
CID 112561640
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 104746160
1-[2-cyclopentyl-2-(propylamino)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 104746159
1-[2-methyl-3-(methylamino)propyl]pyrrolidine-3,4-diol
CID 106673575
ethyl 3-[3-(diethylamino)pyrrolidin-1-yl]-2-(propan-2-ylamino)propanoate
CID 63165603
N,N-diethyl-1-[4-(methylamino)hexyl]pyrrolidin-3-amine
CID 106799808

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine?
The IUPAC name of N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine (CID 63166631) is N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine is CCN(CC)C1CCN(CC(C)CNC)C1.
What is the InChIKey of N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine?
The InChIKey is GTPQSCDRBYXNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3/c1-5-16(6-2)13-7-8-15(11-13)10-12(3)9-14-4/h12-14H,5-11H2,1-4H3.
What are the key properties of N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine?
N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine has a molecular weight of 227.40 g/mol, XLogP of 1.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[2-methyl-3-(methylamino)propyl]pyrrolidin-3-amine is sourced from PubChem (CID 63166631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).