5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine

C11H16BrN3 — CID 114543210

IUPAC5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine
SMILESCC1CCC(Nc2ncc(Br)cc2N)C1
InChIInChI=1S/C11H16BrN3/c1-7-2-3-9(4-7)15-11-10(13)5-8(12)6-14-11/h5-7,9H,2-4,13H2,1H3,(H,14,15)
InChIKeyPLJNPQINYVWXAZ-UHFFFAOYSA-N
MW270.17 g/mol
LogP3.03
Rot. Bonds2

About 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine

5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine (PubChem CID 114543210) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine
PubChem CID114543210
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine
SMILESCC1CCC(Nc2ncc(Br)cc2N)C1
InChIInChI=1S/C11H16BrN3/c1-7-2-3-9(4-7)15-11-10(13)5-8(12)6-14-11/h5-7,9H,2-4,13H2,1H3,(H,14,15)
InChIKeyPLJNPQINYVWXAZ-UHFFFAOYSA-N
XLogP3.03
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-N-(4-propylcyclohexyl)pyridine-2,3-diamine
CID 55185791
5-methyl-2-N-(4-methylcyclohexyl)pyridine-2,3-diamine
CID 66279507
5-bromo-2-N-(1,1-dioxothian-4-yl)pyridine-2,3-diamine
CID 61227510
5-bromo-2-[(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid
CID 63537993
2-amino-5-bromo-N-(3-methylcyclopentyl)pyridine-3-carboxamide
CID 114540575
5-chloro-3-fluoro-N-(3-methylcyclopentyl)pyridin-2-amine
CID 114539767
4-bromo-1-N-(3-methylcyclohexyl)benzene-1,2-diamine
CID 43317802
5-bromo-2-hydrazinylpyridin-3-amine
CID 139593186
5-bromo-2-(cyclopropylamino)pyridine-3-carbonitrile
CID 76848506
3-bromo-2-N-(3,5-dimethylcyclohexyl)-4-methylpyridine-2,5-diamine
CID 104506924
5-bromo-N-(3,4-dimethylcyclohexyl)-3-nitropyridin-2-amine
CID 64744060
[2-[(3-amino-5-bromo-2-pyridinyl)amino]cyclohexyl]methanol
CID 106359094

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine?
The IUPAC name of 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine (CID 114543210) is 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine.
What is the SMILES notation for 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine?
The canonical SMILES for 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine is CC1CCC(Nc2ncc(Br)cc2N)C1.
What is the InChIKey of 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine?
The InChIKey is PLJNPQINYVWXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c1-7-2-3-9(4-7)15-11-10(13)5-8(12)6-14-11/h5-7,9H,2-4,13H2,1H3,(H,14,15).
What are the key properties of 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine?
5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine has a molecular weight of 270.17 g/mol, XLogP of 3.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-N-(3-methylcyclopentyl)pyridine-2,3-diamine is sourced from PubChem (CID 114543210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).