5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine

C13H21BrN2 — CID 63463815

IUPAC5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine
SMILESCC(C)CN(CC(C)C)c1ccc(Br)cn1
InChIInChI=1S/C13H21BrN2/c1-10(2)8-16(9-11(3)4)13-6-5-12(14)7-15-13/h5-7,10-11H,8-9H2,1-4H3
InChIKeyRCEBPLUKKLNFQJ-UHFFFAOYSA-N
MW285.23 g/mol
LogP3.96
Rot. Bonds5

About 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine

5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine (PubChem CID 63463815) has the molecular formula C13H21BrN2 and a molecular weight of 285.23 g/mol. Its IUPAC name is 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine
PubChem CID63463815
Molecular FormulaC13H21BrN2
Molecular Weight285.23 g/mol
Exact Mass284.09
IUPAC Name5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine
SMILESCC(C)CN(CC(C)C)c1ccc(Br)cn1
InChIInChI=1S/C13H21BrN2/c1-10(2)8-16(9-11(3)4)13-6-5-12(14)7-15-13/h5-7,10-11H,8-9H2,1-4H3
InChIKeyRCEBPLUKKLNFQJ-UHFFFAOYSA-N
XLogP3.96
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.23
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-methyl-N-(2-methylpropyl)pyridin-2-amine
CID 61373959
5-(bromomethyl)-N,N-bis(2-methylpropyl)pyridin-2-amine
CID 107080869
5-bromo-N-(2-methylpropyl)-N-pentan-3-ylpyridin-2-amine
CID 79489379
1-[(5-bromo-2-pyridinyl)-methylamino]propan-2-ol
CID 62333552
5-(chloromethyl)-N,N-bis(2-methylpropyl)pyridin-2-amine
CID 61378107
5-hydrazinyl-N,N-bis(2-methylpropyl)pyridin-2-amine
CID 82055094
N-(5-bromo-2-pyridinyl)-N,4-dimethylpentanamide
CID 115274143
5-bromo-N-cyclopropyl-N-(3-methylbutyl)pyridin-2-amine
CID 78974449
6-[bis(2-methylpropyl)amino]pyridine-3-carbothioamide
CID 61378479
5-bromo-N-(2-chloroethyl)-N-ethylpyridin-2-amine
CID 63392030
5-bromo-N-methyl-N-pentan-3-ylpyridin-2-amine
CID 61373581
N-[(5-bromo-2-pyridinyl)methyl]-N-(2-methylpropyl)cyclopropanamine
CID 115622615

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine (CID 63463815) is 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine is CC(C)CN(CC(C)C)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine?
The InChIKey is RCEBPLUKKLNFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21BrN2/c1-10(2)8-16(9-11(3)4)13-6-5-12(14)7-15-13/h5-7,10-11H,8-9H2,1-4H3.
What are the key properties of 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine?
5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine has a molecular weight of 285.23 g/mol, XLogP of 3.96, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N,N-bis(2-methylpropyl)pyridin-2-amine is sourced from PubChem (CID 63463815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).