N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine

C13H27N3 — CID 63209345

IUPACN-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
SMILESCN(CCC1CCCN1)CCN1CCCC1
InChIInChI=1S/C13H27N3/c1-15(10-6-13-5-4-7-14-13)11-12-16-8-2-3-9-16/h13-14H,2-12H2,1H3
InChIKeyUFEFNXDGVVZAAV-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.16
Rot. Bonds6

About N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine

N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine (PubChem CID 63209345) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
PubChem CID63209345
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC NameN-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
SMILESCN(CCC1CCCN1)CCN1CCCC1
InChIInChI=1S/C13H27N3/c1-15(10-6-13-5-4-7-14-13)11-12-16-8-2-3-9-16/h13-14H,2-12H2,1H3
InChIKeyUFEFNXDGVVZAAV-UHFFFAOYSA-N
XLogP1.16
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(piperidin-2-ylmethyl)-2-pyrrolidin-1-ylethanamine
CID 63207373
N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
CID 80696333
2-(azetidin-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 116680014
N,N-dimethyl-1-(2-pyrrolidin-2-ylethyl)piperidin-4-amine
CID 61364502
N,N-dimethyl-2-[(2S)-pyrrolidin-2-yl]ethanamine;dihydrochloride
CID 155100868
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine
CID 61429136
N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine
CID 112659937
N,N-dimethyl-2-[(2S)-piperidin-2-yl]ethanamine
CID 7019358
N,N,N'-trimethyl-N'-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 156728125
N,N-dimethyl-1-(2-piperidin-2-ylethyl)piperidin-4-amine
CID 43586097
N-(2-piperidin-1-ylethyl)-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106631959
N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine
CID 66273209

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine?
The IUPAC name of N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine (CID 63209345) is N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine.
What is the SMILES notation for N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine?
The canonical SMILES for N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine is CN(CCC1CCCN1)CCN1CCCC1.
What is the InChIKey of N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine?
The InChIKey is UFEFNXDGVVZAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-15(10-6-13-5-4-7-14-13)11-12-16-8-2-3-9-16/h13-14H,2-12H2,1H3.
What are the key properties of N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine?
N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine has a molecular weight of 225.38 g/mol, XLogP of 1.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine is sourced from PubChem (CID 63209345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).