3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine

C11H16BrN3 — CID 106876097

IUPAC3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
SMILESCc1ccnc(NCC2CCCN2)c1Br
InChIInChI=1S/C11H16BrN3/c1-8-4-6-14-11(10(8)12)15-7-9-3-2-5-13-9/h4,6,9,13H,2-3,5,7H2,1H3,(H,14,15)
InChIKeyHAYONEQYTMOJFX-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.32
Rot. Bonds3

About 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine

3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine (PubChem CID 106876097) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
PubChem CID106876097
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
SMILESCc1ccnc(NCC2CCCN2)c1Br
InChIInChI=1S/C11H16BrN3/c1-8-4-6-14-11(10(8)12)15-7-9-3-2-5-13-9/h4,6,9,13H,2-3,5,7H2,1H3,(H,14,15)
InChIKeyHAYONEQYTMOJFX-UHFFFAOYSA-N
XLogP2.32
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-4-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 106876235
5-[[(3-bromo-4-methyl-2-pyridinyl)amino]methyl]pyrrolidin-2-one
CID 106875761
3-bromo-4-methyl-N-(pyrrolidin-3-ylmethyl)pyridin-2-amine
CID 106876197
2-chloro-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-3-amine
CID 106638659
3-methoxy-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 83833834
6-fluoro-N-(pyrrolidin-2-ylmethyl)isoquinolin-1-amine
CID 115054238
5-bromo-N-(piperidin-2-ylmethyl)isoquinolin-1-amine
CID 106540424
2-cyclopropyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 83836780
3-bromo-N-[(1,1-dioxothiolan-3-yl)methyl]-4-methylpyridin-2-amine
CID 106875559
3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 104973363
4-methyl-3-nitro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 104972861
2-[(2-bromo-3,6-dimethylphenyl)methyl]pyrrolidine
CID 84808311

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine?
The IUPAC name of 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine (CID 106876097) is 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine is Cc1ccnc(NCC2CCCN2)c1Br.
What is the InChIKey of 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine?
The InChIKey is HAYONEQYTMOJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c1-8-4-6-14-11(10(8)12)15-7-9-3-2-5-13-9/h4,6,9,13H,2-3,5,7H2,1H3,(H,14,15).
What are the key properties of 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine?
3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine has a molecular weight of 270.17 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 106876097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).