N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine

C16H21N3 — CID 153322955

IUPACN-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine
SMILESCN(CCN1CCCC1)c1ccc2ccccc2n1
InChIInChI=1S/C16H21N3/c1-18(12-13-19-10-4-5-11-19)16-9-8-14-6-2-3-7-15(14)17-16/h2-3,6-9H,4-5,10-13H2,1H3
InChIKeyJHXLLIIBBKHCKR-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.77
Rot. Bonds4

About N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine

N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine (PubChem CID 153322955) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine
PubChem CID153322955
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC NameN-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine
SMILESCN(CCN1CCCC1)c1ccc2ccccc2n1
InChIInChI=1S/C16H21N3/c1-18(12-13-19-10-4-5-11-19)16-9-8-14-6-2-3-7-15(14)17-16/h2-3,6-9H,4-5,10-13H2,1H3
InChIKeyJHXLLIIBBKHCKR-UHFFFAOYSA-N
XLogP2.77
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine?
The IUPAC name of N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine (CID 153322955) is N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine.
What is the SMILES notation for N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine?
The canonical SMILES for N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine is CN(CCN1CCCC1)c1ccc2ccccc2n1.
What is the InChIKey of N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine?
The InChIKey is JHXLLIIBBKHCKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-18(12-13-19-10-4-5-11-19)16-9-8-14-6-2-3-7-15(14)17-16/h2-3,6-9H,4-5,10-13H2,1H3.
What are the key properties of N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine?
N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine has a molecular weight of 255.37 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine is sourced from PubChem (CID 153322955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).