N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine

C12H19N3 — CID 141285669

IUPACN-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine
SMILESCN1CCCC1CCNc1ccccn1
InChIInChI=1S/C12H19N3/c1-15-10-4-5-11(15)7-9-14-12-6-2-3-8-13-12/h2-3,6,8,11H,4-5,7,9-10H2,1H3,(H,13,14)
InChIKeyBEQBFYGHXAPUNH-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.98
Rot. Bonds4

About N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine

N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine (PubChem CID 141285669) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine
PubChem CID141285669
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine
SMILESCN1CCCC1CCNc1ccccn1
InChIInChI=1S/C12H19N3/c1-15-10-4-5-11(15)7-9-14-12-6-2-3-8-13-12/h2-3,6,8,11H,4-5,7,9-10H2,1H3,(H,13,14)
InChIKeyBEQBFYGHXAPUNH-UHFFFAOYSA-N
XLogP1.98
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine (CID 141285669) is N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine is CN1CCCC1CCNc1ccccn1.
What is the InChIKey of N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine?
The InChIKey is BEQBFYGHXAPUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-15-10-4-5-11(15)7-9-14-12-6-2-3-8-13-12/h2-3,6,8,11H,4-5,7,9-10H2,1H3,(H,13,14).
What are the key properties of N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine?
N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine has a molecular weight of 205.31 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 141285669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).